BAS 00745222
TL;DR: BAS 00745222 (CAS 312587-49-8) is a chemical compound with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(3-methoxyphenyl)carbamoyl]-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate
Also Known As: BAS 00745222, ethyl 5-[(3-methoxyanilino)carbonyl]-4-methyl-2-[(phenylacetyl)amino]-3-thiophenecarboxylate, ethyl 5-[(3-methoxyphenyl)carbamoyl]-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate, ethyl 5-((3-methoxyphenyl)carbamoyl)-4-methyl-2-(2-phenylacetamido)thiophene-3-carboxylate, ETHYL 5-[(3-METHOXYPHENYL)CARBAMOYL]-4-METHYL-2-(2-PHENYLACETAMIDO)THIOPHENE-3-CARBOXYLATE
| Molecular Formula | C24H24N2O5S |
|---|---|
| Molecular Weight | 452.14 g/mol |
| LogP | 4.67532 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.1406 |
| Heavy Atoms | 32 |
| Complexity | 1124.6732 |
Chemical Identifiers
| CAS Number | 312587-49-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=CC=C2)OC)NC(=O)CC3=CC=CC=C3 |
Product Overview
BAS 00745222 (CAS 312587-49-8), with molecular formula C24H24N2O5S and molecular weight 452.14 g/mol. IUPAC: ethyl 5-[(3-methoxyphenyl)carbamoyl]-4-methyl-2-[(2-phenylacetyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of BAS 00745222
Property Insights of BAS 00745222
The XLogP value of 4.67532 indicates that BAS 00745222 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00745222. Following Lipinski's Rule of Five, BAS 00745222 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 BAS 00745222?
The CAS number of BAS 00745222 is 312587-49-8.
What is the molecular formula of BAS 00745222?
The molecular formula of BAS 00745222 is C24H24N2O5S.
What is the molecular weight of BAS 00745222?
The molecular weight of BAS 00745222 is 452.14 g/mol.
Where can I buy BAS 00745222?
You can request a quote for BAS 00745222 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00745222?
Yes, KEHONG BIO provides custom synthesis services for BAS 00745222 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.