Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate
TL;DR: Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate (CAS 922604-44-2) is a chemical compound with molecular formula C21H19NO5S and molecular weight 397.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(2,3-dimethoxybenzoyl)amino]-5-phenylthiophene-2-carboxylate
Also Known As: methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate, F2516-0125, methyl 3-(2,3-dianisoylamino)-5-phenyl-2-thenoate, methyl 3-[(2,3-dimethoxybenzoyl)amino]-5-phenylthiophene-2-carboxylate
| Molecular Formula | C21H19NO5S |
|---|---|
| Molecular Weight | 397.10 g/mol |
| LogP | 4.4712 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.0984 |
| Heavy Atoms | 28 |
| Complexity | 997.28546 |
Chemical Identifiers
| CAS Number | 922604-44-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OC |
Product Overview
Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate (CAS 922604-44-2), with molecular formula C21H19NO5S and molecular weight 397.10 g/mol. IUPAC: methyl 3-[(2,3-dimethoxybenzoyl)amino]-5-phenylthiophene-2-carboxylate.
Chemical Property Profile of Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate
Property Insights of Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate
The XLogP value of 4.4712 indicates that Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate. Following Lipinski's Rule of Five, Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate has 1 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 Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate?
The CAS number of Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate is 922604-44-2.
What is the molecular formula of Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate?
The molecular formula of Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate is C21H19NO5S.
What is the molecular weight of Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate?
The molecular weight of Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate is 397.10 g/mol.
Where can I buy Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate?
You can request a quote for Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(2,3-dimethoxybenzamido)-5-phenylthiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.