Clorazepate
TL;DR: Clorazepate (CAS 23887-31-2) is a chemical compound with molecular formula C16H11ClN2O3 and molecular weight 314.0458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid
Also Known As: clorazepate, Clorazepic acid, Chlorazepate, Cchlorazepic acid, Tranxene
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H11ClN2O3 |
| Molecular Weight | 314.0458 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 314.0458 Da |
| Heavy Atoms | 22 |
| Complexity | 488.0 |
| Melting Point | 228-235°C |
| Solubility | Very soluble |
| SMILES | C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)O |
| InChIKey | XDDJGVMJFWAHJX-UHFFFAOYSA-N |
Product Description
Applications: Clorazepate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Clorazepate is a pharmaceutical intermediate identified by CAS number 23887-31-2 and the molecular formula C16H11ClN2O3 and a molecular weight of 314.05 g/mol. Physically, the compound has a solubility: Very soluble. Synonyms include clorazepate and Clorazepic acid.
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 Clorazepate
Property Insights of Clorazepate
The XLogP value of 3.3 indicates that Clorazepate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Clorazepate. Following Lipinski's Rule of Five, Clorazepate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Clorazepate?
The CAS number of Clorazepate is 23887-31-2.
What is the molecular formula of Clorazepate?
The molecular formula of Clorazepate is C16H11ClN2O3.
What is the molecular weight of Clorazepate?
The molecular weight of Clorazepate is 314.0458 g/mol.
What are the applications of Clorazepate?
Clorazepate is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Clorazepate?
You can request a quote for Clorazepate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Clorazepate?
Yes, CoreyChem provides custom synthesis services for Clorazepate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.