3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide
TL;DR: 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide (CAS 313962-10-6) is a chemical compound with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide
Also Known As: 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide, BAS 00668123, 2-Amino-6-phenoxy-4(1H)-pyrimidinone, BIM-0000364.P001, 3-chloro-N-(6-ethoxybenzo[d]thiazol-2-yl)benzamide
| Molecular Formula | C16H13ClN2O2S |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.03864 |
| Heavy Atoms | 22 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 313962-10-6 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)Cl |
| InChIKey | XODPTEDFIKTXCZ-UHFFFAOYSA-N |
Product Overview
3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide (CAS 313962-10-6), with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol. IUPAC: 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide.
Chemical Property Profile of 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide
Property Insights of 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide
The XLogP value of 4.5 indicates that 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide has 1 hydrogen bond donor(s) and 4 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 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide?
The CAS number of 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide is 313962-10-6.
What is the molecular formula of 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide?
The molecular formula of 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide is C16H13ClN2O2S.
What is the molecular weight of 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide?
The molecular weight of 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide is 332.04 g/mol.
Where can I buy 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide?
You can request a quote for 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(6-ethoxy-1,3-benzothiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.