Vardenafil Hydrochloride Trihydrate

Basic Information

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CAS Number

330808-88-3

Molecular Formula

C23H39ClN6O7S

Molecular Weight

579.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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CCCC1=NC(=C2N1N=C(NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)OCC)C.O.O.O.Cl

InChI

InChI=1S/C23H32N6O4S.ClH.3H2O/c1-5-8-20-24-16(4)21-23(30)25-22(26-29(20)21)18-15-17(9-10-19(18)33-7-3)34(31,32)28-13-11-27(6-2)12-14-28;;;;/h9-10,15H,5-8,11-14H2,1-4H3,(H,25,26,30);1H;3*1H2

InChIKey

FBCDRHDULQYRTB-UHFFFAOYSA-N

LogP

0.018119999999999803

Topological Polar Surface Area

207.40000000000003 Å²

Hydrogen Bond Donor/Acceptor

7 / 13

Complexity

854

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

VARDENAFIL HYDROCHLORIDE TRIHYDRATE [EP MONOGRAPH]
AKOS015966861
Vardenafil HCl Trihydrate
VARDENAFIL HYDROCHLORIDE HYDRATE [JAN]
HY-B0442B
VARDENAFIL HYDROCHLORIDE TRIHYDRATE [WHO-DD]
BAY 38-9456
Vardenafil hydrochloride hydrate
DTXSID30954704
BAY38-9456
s2515
VARDENAFIL TRIHYDRATE HYDROCHLORIDE
Q27262554
Nuviva
2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methyl-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-4-one trihydrate hydrochloride
C23H39ClN6O7S
VARDENAFIL HYDROCHLORIDE [ORANGE BOOK]
MFCD08458876
Vardenafil hydrochloride trihydrate
UNII-5M8S2CU0TS
AKOS015895117
Staxyn
CCG-270124
2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one trihydrate hydrochloride
Vardenafil hydrochloride hydrate (JAN)
330808-88-3
A816221
KS-1318
2-(2-ethoxy-5-((4-ethylpiperazin-1-yl)sulfonyl)phenyl)-5-methyl-7-propylimidazo[5,1-f][1,2,4]triazin-4(1H)-onehydrochloridetrihydrate
CS-0019750
2-[2-ethoxy-5-(4-ethylpiperazin-1-yl)sulfonylphenyl]-5-methyl-7-propyl-3H-imidazo[5,1-f][1,2,4]triazin-4-one;trihydrate;hydrochloride

MDL Number

MFCD08458876

FAQ

What are the physical and chemical properties of Vardenafil Hydrochloride Trihydrate (CAS: 330808-88-3)?

Vardenafil Hydrochloride Trihydrate (CAS: 330808-88-3) is a crystalline solid with a molecular weight of approximately 633.8 g/mol. It has a solubility of about 25 mg/mL in water and exhibits limited solubility in organic solvents. Chemically, it is highly stable under normal conditions but can degrade upon exposure to moisture and heat. It is moderately reactive with bases and can undergo hydrolysis under acidic conditions.

How is Vardenafil Hydrochloride Trihydrate (CAS: 330808-88-3) typically synthesized?

Vardenafil Hydrochloride Trihydrate is typically synthesized via a multi-step process involving the synthesis of the parent vardenafil molecule followed by the addition of hydrochloric acid and water to form the trihydrate. The synthesis involves protecting groups, coupling reactions, and deprotection steps. The final product is crystallized from a suitable solvent, and the trihydrate form is obtained by hydrating the hydrochloride salt under controlled conditions.

What industries use Vardenafil Hydrochloride Trihydrate (CAS: 330808-88-3)?

Vardenafil Hydrochloride Trihydrate (CAS: 330808-88-3) is primarily used in the pharmaceutical industry for the production of the erectile dysfunction drug Levitra. It is also explored for other therapeutic applications, including potential uses in treating benign prostatic hyperplasia and pulmonary arterial hypertension. Additionally, its chemical structure and properties may be of interest in academic research and other specialized fields.

What precautions should be taken when handling Vardenafil Hydrochloride Trihydrate (CAS: 330808-88-3)?

When handling Vardenafil Hydrochloride Trihydrate (CAS: 330808-88-3), it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. Store the compound in a cool, dry place away from moisture and heat. Use a fume hood during handling to avoid inhalation of dust or aerosols. In case of a spill, promptly clean up using appropriate procedures and ensure proper disposal. Always refer to the Safety Data Sheet (SDS) for specific handling instructions and emergency procedures.