AN-329/41573527
TL;DR: AN-329/41573527 (CAS 497091-58-4) is a chemical compound with molecular formula C20H18ClN3O3S3 and molecular weight 479.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
Also Known As: AN-329/41573527, 3-chloro-N-((4-(pyrrolidin-1-ylsulfonyl)phenyl)carbamothioyl)benzo[b]thiophene-2-carboxamide, F1443-3559, 3-(3-CHLORO-1-BENZOTHIOPHENE-2-CARBONYL)-1-[4-(PYRROLIDINE-1-SULFONYL)PHENYL]THIOUREA, 3-chloro-N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
| Molecular Formula | C20H18ClN3O3S3 |
|---|---|
| Molecular Weight | 479.02 g/mol |
| LogP | 4.466 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 479.0199 |
| Heavy Atoms | 30 |
| Complexity | 1217.0726 |
Chemical Identifiers
| CAS Number | 497091-58-4 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
AN-329/41573527 (CAS 497091-58-4), with molecular formula C20H18ClN3O3S3 and molecular weight 479.02 g/mol. IUPAC: 3-chloro-N-[(4-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of AN-329/41573527
Property Insights of AN-329/41573527
The XLogP value of 4.466 indicates that AN-329/41573527 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/41573527. Following Lipinski's Rule of Five, AN-329/41573527 has 2 hydrogen bond donor(s) and 5 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 AN-329/41573527?
The CAS number of AN-329/41573527 is 497091-58-4.
What is the molecular formula of AN-329/41573527?
The molecular formula of AN-329/41573527 is C20H18ClN3O3S3.
What is the molecular weight of AN-329/41573527?
The molecular weight of AN-329/41573527 is 479.02 g/mol.
Where can I buy AN-329/41573527?
You can request a quote for AN-329/41573527 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/41573527?
Yes, KEHONG BIO provides custom synthesis services for AN-329/41573527 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.