AN-465/40934554
TL;DR: AN-465/40934554 (CAS 433698-78-3) is a chemical compound with molecular formula C23H16ClN5O2S and molecular weight 461.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[6-chloro-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: AN-465/40934554, N-[[6-chloro-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide, N-(1-benzofuran-2-ylcarbonyl)-N'-[6-chloro-2-(4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]thiourea, N-{[6-chloro-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
| Molecular Formula | C23H16ClN5O2S |
|---|---|
| Molecular Weight | 461.07 g/mol |
| LogP | 5.25532 |
| Topological Polar Surface Area | 84.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 461.07132 |
| Heavy Atoms | 32 |
| Complexity | 1456.8931 |
Chemical Identifiers
| CAS Number | 433698-78-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4 |
Product Overview
AN-465/40934554 (CAS 433698-78-3), with molecular formula C23H16ClN5O2S and molecular weight 461.07 g/mol. IUPAC: N-[[6-chloro-2-(4-methylphenyl)benzotriazol-5-yl]carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of AN-465/40934554
Property Insights of AN-465/40934554
The XLogP value of 5.25532 indicates that AN-465/40934554 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.98 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/40934554. Following Lipinski's Rule of Five, AN-465/40934554 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AN-465/40934554?
The CAS number of AN-465/40934554 is 433698-78-3.
What is the molecular formula of AN-465/40934554?
The molecular formula of AN-465/40934554 is C23H16ClN5O2S.
What is the molecular weight of AN-465/40934554?
The molecular weight of AN-465/40934554 is 461.07 g/mol.
Where can I buy AN-465/40934554?
You can request a quote for AN-465/40934554 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/40934554?
Yes, KEHONG BIO provides custom synthesis services for AN-465/40934554 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.