![propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate structure](/static/products/5148/514837-58-2.webp)
propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate
TL;DR: propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate (CAS 514837-58-2) is a chemical compound with molecular formula C23H19ClF2N2O4S and molecular weight 492.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate, isopropyl 5-[(4-chloroanilino)carbonyl]-2-[(2,6-difluorobenzoyl)amino]-4-methyl-3-thiophenecarboxylate, methylethyl 2-[(2,6-difluorophenyl)carbonylamino]-5-[N-(4-chlorophenyl)carbamo yl]-4-methylthiophene-3-carboxylate, propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-{[(2,6-difluorophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate
| Molecular Formula | C23H19ClF2N2O4S |
|---|---|
| Molecular Weight | 492.07 g/mol |
| LogP | 6.05792 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 492.0722 |
| Heavy Atoms | 33 |
| Complexity | 1205.6945 |
Chemical Identifiers
| CAS Number | 514837-58-2 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=C(C=CC=C2F)F)C(=O)NC3=CC=C(C=C3)Cl |
Product Overview
propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate (CAS 514837-58-2), with molecular formula C23H19ClF2N2O4S and molecular weight 492.07 g/mol. IUPAC: propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate
Property Insights of propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate
The XLogP value of 6.05792 indicates that propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-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 propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-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 propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate?
The CAS number of propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate is 514837-58-2.
What is the molecular formula of propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate?
The molecular formula of propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate is C23H19ClF2N2O4S.
What is the molecular weight of propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate?
The molecular weight of propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate is 492.07 g/mol.
Where can I buy propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate?
You can request a quote for propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl 5-[(4-chlorophenyl)carbamoyl]-2-[(2,6-difluorobenzoyl)amino]-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.