N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide
TL;DR: N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide (CAS 681168-80-9) 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-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide
Also Known As: Maybridge4_003724, KSC-242-036-K, N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide, BRD-K78264158-001-01-2
| Molecular Formula | C14H9ClN2OS |
|---|---|
| Molecular Weight | 288.01 g/mol |
| LogP | 3.8 |
| 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 | 333.0 |
Chemical Identifiers
| CAS Number | 681168-80-9 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C2=CC3=C(C=C2)N=CS3)Cl |
| InChIKey | AVAVXKWYUWZUAM-UHFFFAOYSA-N |
Product Overview
N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide (CAS 681168-80-9), with molecular formula C14H9ClN2OS and molecular weight 288.01 g/mol. IUPAC: N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide.
Chemical Property Profile of N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide
Property Insights of N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide
The XLogP value of 3.8 indicates that N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide 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-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide. Following Lipinski's Rule of Five, N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide 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-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide?
The CAS number of N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide is 681168-80-9.
What is the molecular formula of N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide?
The molecular formula of N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide is C14H9ClN2OS.
What is the molecular weight of N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide?
The molecular weight of N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide is 288.01 g/mol.
Where can I buy N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide?
You can request a quote for N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chlorophenyl)-1,3-benzothiazole-6-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.