AN-465/41165351
TL;DR: AN-465/41165351 (CAS 445418-80-4) is a chemical compound with molecular formula C20H21ClN2O6S2 and molecular weight 484.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-O-ethyl 2-O-methyl 5-[(3-chloro-4-ethoxybenzoyl)carbamothioylamino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: AN-465/41165351, 4-ethyl 2-methyl 5-({[(3-chloro-4-ethoxybenzoyl)amino]carbothioyl}amino)-3-methyl-2,4-thiophenedicarboxylate, 4-ethyl 2-methyl 5-(3-(3-chloro-4-ethoxybenzoyl)thioureido)-3-methylthiophene-2,4-dicarboxylate, 4-O-ethyl 2-O-methyl 5-[(3-chloro-4-ethoxybenzoyl)carbamothioylamino]-3-methylthiophene-2,4-dicarboxylate, 4-ethyl 2-methyl 5-({[(3-chloro-4-ethoxyphenyl)carbonyl]carbamothioyl}amino)-3-methylthiophene-2,4-dicarboxylate
| Molecular Formula | C20H21ClN2O6S2 |
|---|---|
| Molecular Weight | 484.05 g/mol |
| LogP | 4.19872 |
| Topological Polar Surface Area | 102.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.05295 |
| Heavy Atoms | 31 |
| Complexity | 1021.3393 |
Chemical Identifiers
| CAS Number | 445418-80-4 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OCC)Cl |
Product Overview
AN-465/41165351 (CAS 445418-80-4), with molecular formula C20H21ClN2O6S2 and molecular weight 484.05 g/mol. IUPAC: 4-O-ethyl 2-O-methyl 5-[(3-chloro-4-ethoxybenzoyl)carbamothioylamino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of AN-465/41165351
Property Insights of AN-465/41165351
The XLogP value of 4.19872 indicates that AN-465/41165351 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-465/41165351. Following Lipinski's Rule of Five, AN-465/41165351 has 2 hydrogen bond donor(s) and 8 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-465/41165351?
The CAS number of AN-465/41165351 is 445418-80-4.
What is the molecular formula of AN-465/41165351?
The molecular formula of AN-465/41165351 is C20H21ClN2O6S2.
What is the molecular weight of AN-465/41165351?
The molecular weight of AN-465/41165351 is 484.05 g/mol.
Where can I buy AN-465/41165351?
You can request a quote for AN-465/41165351 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-465/41165351?
Yes, KEHONG BIO provides custom synthesis services for AN-465/41165351 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.