![methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate structure](/static/products/4924/492433-86-0.webp)
methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate
TL;DR: methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate (CAS 492433-86-0) is a chemical compound with molecular formula C24H23ClN2O4S and molecular weight 470.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(4-phenylbutanoylamino)thiophene-3-carboxylate
Also Known As: methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate, methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(4-phenylbutanoylamino)thiophene-3-carboxylate, methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate, methyl 5-[N-(4-chlorophenyl)carbamoyl]-4-methyl-2-(4-phenylbutanoylamino)thiop hene-3-carboxylate
| Molecular Formula | C24H23ClN2O4S |
|---|---|
| Molecular Weight | 470.11 g/mol |
| LogP | 5.71022 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 470.10672 |
| Heavy Atoms | 32 |
| Complexity | 1111.0328 |
Chemical Identifiers
| CAS Number | 492433-86-0 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)CCCC2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)Cl |
Product Overview
methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate (CAS 492433-86-0), with molecular formula C24H23ClN2O4S and molecular weight 470.11 g/mol. IUPAC: methyl 5-[(4-chlorophenyl)carbamoyl]-4-methyl-2-(4-phenylbutanoylamino)thiophene-3-carboxylate.
Chemical Property Profile of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate
Property Insights of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate
The XLogP value of 5.71022 indicates that methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate?
The CAS number of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate is 492433-86-0.
What is the molecular formula of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate?
The molecular formula of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate is C24H23ClN2O4S.
What is the molecular weight of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate?
The molecular weight of methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate is 470.11 g/mol.
Where can I buy methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate?
You can request a quote for methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[(4-chloroanilino)carbonyl]-4-methyl-2-[(4-phenylbutanoyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.