![N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide structure](/static/products/833/833444-74-9.png)
N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide
TL;DR: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide (CAS 833444-74-9) is a chemical compound with molecular formula C18H16ClN3O2S and molecular weight 373.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide
Also Known As: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide, AP-970/43204581, N-[2-(butyrylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide
| Molecular Formula | C18H16ClN3O2S |
|---|---|
| Molecular Weight | 373.07 g/mol |
| LogP | 4.9406 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.0652 |
| Heavy Atoms | 25 |
| Complexity | 921.7208 |
Chemical Identifiers
| CAS Number | 833444-74-9 |
|---|---|
| SMILES | CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl |
Product Overview
N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide (CAS 833444-74-9), with molecular formula C18H16ClN3O2S and molecular weight 373.07 g/mol. IUPAC: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide.
Chemical Property Profile of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide
Property Insights of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide
The XLogP value of 4.9406 indicates that N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide. Following Lipinski's Rule of Five, N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide 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
Frequently Asked Questions
What is the CAS number of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide?
The CAS number of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide is 833444-74-9.
What is the molecular formula of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide?
The molecular formula of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide is C18H16ClN3O2S.
What is the molecular weight of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide?
The molecular weight of N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide is 373.07 g/mol.
Where can I buy N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide?
You can request a quote for N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-4-chlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.