Rifapentine | CAS No. 61379-65-5

Rifapentine

Basic Information

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CAS Number

61379-65-5

Molecular Formula

C47H64N4O12

Molecular Weight

877.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

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

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

179-180°C

Solubility

methanol: soluble2mg/mL, clear, red to red-brown

SMILES

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CO[C@H]1/C=C/O[C@@]2(C)Oc3c(C2=O)c2c(O)c(/C=N/N4CCN(CC4)C4CCCC4)c(c(c2c(c3C)O)O)NC(=O)/C(=C\C=C\[C@@H]([C@@H]([C@H]([C@H]([C@H]([C@@H]([C@@H]1C)OC(=O)C)C)O)C)O)C)/C

InChI

InChI=1S/C47H64N4O12/c1-24-13-12-14-25(2)46(59)49-37-32(23-48-51-20-18-50(19-21-51)31-15-10-11-16-31)41(56)34-35(42(37)57)40(55)29(6)44-36(34)45(58)47(8,63-44)61-22-17-33(60-9)26(3)43(62-30(7)52)28(5)39(54)27(4)38(24)53/h12-14,17,22-24,26-28,31,33,38-39,43,53-57H,10-11,15-16,18-21H2,1-9H3,(H,49,59)/b13-12+,22-17+,25-14-,48-23+/t24-,26+,27+,28+,33-,38-,39+,43+,47-/m0/s1

InChIKey

WDZCUPBHRAEYDL-GZAUEHORSA-N

LogP

5.648220000000008

Topological Polar Surface Area

220.14999999999995 Å²

Hydrogen Bond Donor/Acceptor

6 / 16

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

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

Toxicity

LD50 in mice (mg/kg): >2000 orally; 750 i.p. (Cricchio); LD50 in mice (mg/kg): 3300 orally; 710 i.p. (Aroli)

Synonyms & References

English

Rifapentine
3-(((4-cyclopentyl-1-piperazinyl)imino)methyl)-rifamyci
3-(4-cyclopentyl-1-piperazinyl)iminomethylrifamycinsv
antibioticdl473it
dl473
ktc1
mdl473
r-773
Cyclopentylrifampicin
rifamycin-B tripropylhydrazide
Rifamycin-B-tripropyl-hydrazid
rifamycin-S
3{[(4-Cyclopentyl-1-piperazinyl)imino]methyl}rifamycin
3-[[(4-Cyclopentyl-1-piperazinyl)imino]methyl]rifamycin

MDL Number

MFCD00866806

Customs Code

2941903000

FAQ

What regulatory guidelines apply to Rifapentine (CAS: 61379-65-5)?

Rifapentine (CAS: 61379-65-5) is subject to various regulatory guidelines including GHS classification, REACH regulations, and FDA/EPA requirements. It is classified as a pharmaceutical substance and must comply with strict safety and quality standards. Specific regulations include documentation of safety data sheets (SDS), adherence to Good Manufacturing Practices (GMP), and adherence to transportation and storage guidelines to ensure safety and efficacy.

Are there alternatives to Rifapentine (CAS: 61379-65-5) in synthesis?

In synthesis, Rifapentine (CAS: 61379-65-5) can be synthesized using analogs such as rifaprost and rifapentine derivatives. Common alternative reagents include halides, sulfonates, and carboxylates. For safer and more efficient synthesis, isomers like rifapentine-A and rifapentine-B can also be used as alternatives.

What is the market or research trend for Rifapentine (CAS: 61379-65-5)?

The market for Rifapentine (CAS: 61379-65-5) is growing due to its effectiveness in treating tuberculosis and other bacterial infections. Research trends focus on optimizing its delivery systems, such as lipid formulations and inhalation therapies. Recent studies are also exploring its use in combination with other drugs to improve treatment outcomes and reduce resistance. Market demand is robust, with a growing emphasis on personalized and targeted therapies.

How should waste containing Rifapentine (CAS: 61379-65-5) be handled?

Waste containing Rifapentine (CAS: 61379-65-5) should be collected in designated, leak-proof containers and stored in a secure, well-ventilated area. Proper incineration or professional waste disposal is recommended, adhering to local environmental regulations. Precautions include wearing appropriate protective gear and ensuring proper ventilation to prevent inhalation or skin contact. Environmental protection measures include monitoring for any potential contamination and following best practices for waste management to minimize ecological impact.