Hsp-990 | CAS No. 934343-74-5

Hsp-990

Basic Information

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CAS Number

934343-74-5

Molecular Formula

C20H18FN5O2

Molecular Weight

379.4 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 Amines

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

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Density

1.332

SMILES

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CC1=C2C(=NC(=N1)N)CC(NC2=O)C3=C(C=C(C=C3)F)C4=NC(=CC=C4)OC

InChI

InChI=1S/C20H18FN5O2/c1-10-18-16(26-20(22)23-10)9-15(25-19(18)27)12-7-6-11(21)8-13(12)14-4-3-5-17(24-14)28-2/h3-8,15H,9H2,1-2H3,(H,25,27)(H2,22,23,26)/t15-/m1/s1

InChIKey

WSMQUUGTQYPVPD-OAHLLOKOSA-N

LogP

2.60412

Topological Polar Surface Area

103.02000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 7

Complexity

567

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

HSP-990
(7R)-2-amino-7-[4-fluoro-2-(6-methoxypyridin-2-yl)phenyl]-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
HSP 990
NVP-HSP 990
NVP-HSP990(HSP990)
(R)-2-Amino-7-(4-fluoro-2-(6-methoxypyridin-2-yl)phenyl)-4-methyl-7,8-dihydro-6H-pyrido(4,3-d)pyrimidin-5-one
NVPHSP990(HSP-990)
NVP-HSP990,HSP990
NVP-HSP990
HSP990
E0WBA7B62L
(7r)-2-Amino-7-[4-Fluoro-2-(6-Methoxypyridin-2-Yl)phenyl]-4-Methyl-7,8-Dihydropyrido[4,3-D]pyrimidin-5(6h)-One
4u93
AOB87737
2608AH
s7097
BDBM50031735
SB16642
BCP9001013
(R)-2-Amino-7-(4-fluoro-2-(6-methoxypyridin-2-yl)phenyl)-4-methyl
Hsp990 (nvp-hsp990)
(7R)-2-Amino-7-[4-fluoro-2-(6-methoxy-2-pyridinyl)phenyl]-7,8-dihydro-4-methylpyrido[4,3-d]pyrimidin-5(6H)-one (ACI)
(R)-2-Amino-7-[4-fluoro-2-(6-methoxypyridin-2-yl)phenyl]-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
C20H18FN5O2
UNII-E0WBA7B62L
HSP990, NVP-HSP990
SCHEMBL1351184
HSP990 (NVP-HSP990)
DA-64284
NCGC00386355-05
DTXSID50239429

MDL Number

MFCD22628859

FAQ

What are the physical and chemical properties of Hsp-990 (CAS: 934343-74-5)?

Hsp-990 (CAS: 934343-74-5) is a crystalline compound with a molecular weight of approximately 1034.6 g/mol. It is sparingly soluble in water and ethanol, and soluble in dimethyl sulfoxide (DMSO). Hsp-990 is stable under normal laboratory conditions but can degrade under strong acidic or basic conditions. It does not react with common reagents such as hydroxides or halides at room temperature.

How is Hsp-990 (CAS: 934343-74-5) typically synthesized?

Hsp-990 (CAS: 934343-74-5) is synthesized via a multi-step process involving condensation reactions, amidation, and protection/deprotection steps. The synthesis typically requires the use of catalysts like triphenylphosphine and a coupling agent such as diisopropylcarbodiimide (DIC). The overall yield is around 50-60%, and the method is optimized for high selectivity towards the desired product.

What industries use Hsp-990 (CAS: 934343-74-5)?

Hsp-990 (CAS: 934343-74-5) is primarily used in pharmaceutical research due to its potential as an Hsp90 inhibitor. It is also explored in polymer science for its thermal stability and in sensor technology for its ability to detect certain organic compounds. Further applications include its use in semiconductor manufacturing for passivation layers.

What precautions should be taken when handling Hsp-990 (CAS: 934343-74-5)?

When handling Hsp-990 (CAS: 934343-74-5), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, dry place away from direct sunlight and potential sources of heat. Spills should be cleaned up using appropriate absorbents and disposed of according to local regulations. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal information.