N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide
TL;DR: N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide (CAS 123294-55-3) is a chemical compound with molecular formula C14H9ClN2OS and molecular weight 288.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2-chlorobenzamide
Also Known As: N-(1,3-Benzothiazol-2-yl)-2-chlorobenzamide, N-Benzothiazol-2-yl-2-chloro-benzamide, 2-Aminobenzothiazole,N-2-chlorobenzoyl-, 2-chloro-N-(benzothiazol-2-yl)benzamide, BAS 00539750
| Molecular Formula | C14H9ClN2OS |
|---|---|
| Molecular Weight | 288.01 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.01242 |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 123294-55-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=NC3=CC=CC=C3S2)Cl |
| InChIKey | KRXNBZMOCGTCFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide (CAS 123294-55-3), with molecular formula C14H9ClN2OS and molecular weight 288.01 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-chlorobenzamide.
Chemical Property Profile of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide
Property Insights of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide
The XLogP value of 4.2 indicates that N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide. Following Lipinski's Rule of Five, N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide?
The CAS number of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide is 123294-55-3.
What is the molecular formula of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide?
The molecular formula of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide is C14H9ClN2OS.
What is the molecular weight of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide?
The molecular weight of N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide is 288.01 g/mol.
Where can I buy N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide?
You can request a quote for N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-Benzothiazol-2-YL)-2-chlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.