AN-465/40810936
TL;DR: AN-465/40810936 (CAS 429640-75-5) is a chemical compound with molecular formula C21H19N5O2S2 and molecular weight 437.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]thiophene-2-carboxamide
Also Known As: AN-465/40810936, N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]thiophene-2-carboxamide, N-{[2-(4-ethoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}thiophene-2-carboxamide, N-[2-(4-ethoxyphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]-N'-(2-thienylcarbonyl)thiourea
| Molecular Formula | C21H19N5O2S2 |
|---|---|
| Molecular Weight | 437.10 g/mol |
| LogP | 4.31592 |
| Topological Polar Surface Area | 81.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.09802 |
| Heavy Atoms | 30 |
| Complexity | 1200.3527 |
Chemical Identifiers
| CAS Number | 429640-75-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC=CS4)C |
Product Overview
AN-465/40810936 (CAS 429640-75-5), with molecular formula C21H19N5O2S2 and molecular weight 437.10 g/mol. IUPAC: N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]thiophene-2-carboxamide.
Chemical Property Profile of AN-465/40810936
Property Insights of AN-465/40810936
The XLogP value of 4.31592 indicates that AN-465/40810936 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/40810936. Following Lipinski's Rule of Five, AN-465/40810936 has 2 hydrogen bond donor(s) and 6 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-465/40810936?
The CAS number of AN-465/40810936 is 429640-75-5.
What is the molecular formula of AN-465/40810936?
The molecular formula of AN-465/40810936 is C21H19N5O2S2.
What is the molecular weight of AN-465/40810936?
The molecular weight of AN-465/40810936 is 437.10 g/mol.
Where can I buy AN-465/40810936?
You can request a quote for AN-465/40810936 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/40810936?
Yes, KEHONG BIO provides custom synthesis services for AN-465/40810936 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.