AS-871/42863931
TL;DR: AS-871/42863931 (CAS 692279-99-5) is a chemical compound with molecular formula C18H17Cl2NO5S and molecular weight 429.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-acetyl-2-[(3,5-dichloro-4-ethoxybenzoyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: AS-871/42863931, methyl 5-acetyl-2-[(3,5-dichloro-4-ethoxybenzoyl)amino]-4-methyl-3-thiophenecarboxylate, methyl 5-acetyl-2-[(3,5-dichloro-4-ethoxybenzoyl)amino]-4-methylthiophene-3-carboxylate, METHYL 5-ACETYL-2-(3,5-DICHLORO-4-ETHOXYBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE, Methyl 5-acetyl-2-[(3,5-dichloro-4-ethoxy-benzoyl)amino]-4-methyl-thiophene-3-carboxylate
| Molecular Formula | C18H17Cl2NO5S |
|---|---|
| Molecular Weight | 429.02 g/mol |
| LogP | 5.00352 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.02045 |
| Heavy Atoms | 27 |
| Complexity | 899.7112 |
Chemical Identifiers
| CAS Number | 692279-99-5 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1Cl)C(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OC)Cl |
Product Overview
AS-871/42863931 (CAS 692279-99-5), with molecular formula C18H17Cl2NO5S and molecular weight 429.02 g/mol. IUPAC: methyl 5-acetyl-2-[(3,5-dichloro-4-ethoxybenzoyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of AS-871/42863931
Property Insights of AS-871/42863931
The XLogP value of 5.00352 indicates that AS-871/42863931 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for AS-871/42863931. Following Lipinski's Rule of Five, AS-871/42863931 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AS-871/42863931?
The CAS number of AS-871/42863931 is 692279-99-5.
What is the molecular formula of AS-871/42863931?
The molecular formula of AS-871/42863931 is C18H17Cl2NO5S.
What is the molecular weight of AS-871/42863931?
The molecular weight of AS-871/42863931 is 429.02 g/mol.
Where can I buy AS-871/42863931?
You can request a quote for AS-871/42863931 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/42863931?
Yes, KEHONG BIO provides custom synthesis services for AS-871/42863931 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.