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Chlordiazepoxide hydrochloride structure
Fine Chemical

Chlordiazepoxide hydrochloride

TL;DR: Chlordiazepoxide hydrochloride (CAS 438-41-5) is a chemical compound with molecular formula C16H15Cl2N3O and molecular weight 335.0592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

7-chloro-4-hydroxy-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-imine;hydrochloride

Also Known As: Librium, Clopoxide chloride, Chlordiazachel, Protensin, Calmoden

CAS Number
438-41-5
Molecular Formula
C16H15Cl2N3O
Molecular Weight
335.0592 g/mol
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Technical Specifications

Molecular FormulaC16H15Cl2N3O
Molecular Weight335.0592 g/mol
XLogP2.27
Topological Polar Surface Area (TPSA)48.2 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds1
Exact Mass335.0592 Da
Heavy Atoms22
Complexity580.0
SMILESCN=C1CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O.Cl
InChIKeyPRNVHVUEIITLRV-UHFFFAOYSA-N

Product Description

Applications: Chlordiazepoxide hydrochloride is used in organic synthesis and process chemistry. It commonly serves as an oxidizing agent in synthetic sequences. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Chlordiazepoxide hydrochloride (CAS 438-41-5) is a fine chemical with the molecular formula C16H15Cl2N3O and a molecular weight of 335.06 g/mol. Synonyms include Librium and Clopoxide chloride.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Chlordiazepoxide hydrochloride

XLogP
2.27
TPSA (Topological Polar Surface Area)
48.2
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
1
Heavy Atoms
22
Complexity
580.0
Exact Mass
335.0592
Monoisotopic Mass
335.0592
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Chlordiazepoxide hydrochloride

The XLogP value of 2.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chlordiazepoxide hydrochloride. With a topological polar surface area (TPSA) of 48.2 Ų, Chlordiazepoxide hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlordiazepoxide hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Chlordiazepoxide hydrochloride?

The CAS number of Chlordiazepoxide hydrochloride is 438-41-5.

What is the molecular formula of Chlordiazepoxide hydrochloride?

The molecular formula of Chlordiazepoxide hydrochloride is C16H15Cl2N3O.

What is the molecular weight of Chlordiazepoxide hydrochloride?

The molecular weight of Chlordiazepoxide hydrochloride is 335.0592 g/mol.

What are the applications of Chlordiazepoxide hydrochloride?

Chlordiazepoxide hydrochloride is used in organic synthesis and process chemistry. It commonly serves as an oxidizing agent in synthetic sequences. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Where can I buy Chlordiazepoxide hydrochloride?

You can request a quote for Chlordiazepoxide hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Chlordiazepoxide hydrochloride?

Yes, CoreyChem provides custom synthesis services for Chlordiazepoxide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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