![propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate structure](/static/products/4450/445004-89-7.webp)
propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
TL;DR: propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate (CAS 445004-89-7) is a chemical compound with molecular formula C18H20ClNO4S and molecular weight 381.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
Also Known As: propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate, isopropyl 2-{[(2-chlorophenoxy)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate, ISOPROPYL 2-{[2-(2-CHLOROPHENOXY)ACETYL]AMINO}-4,5-DIMETHYL-3-THIOPHENECARBOXYLATE, propan-2-yl 2-{[(2-chlorophenoxy)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate
| Molecular Formula | C18H20ClNO4S |
|---|---|
| Molecular Weight | 381.08 g/mol |
| LogP | 4.60104 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 381.08017 |
| Heavy Atoms | 25 |
| Complexity | 785.3784 |
Chemical Identifiers
| CAS Number | 445004-89-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)COC2=CC=CC=C2Cl)C |
Product Overview
propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate (CAS 445004-89-7), with molecular formula C18H20ClNO4S and molecular weight 381.08 g/mol. IUPAC: propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate.
Chemical Property Profile of propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
Property Insights of propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate
The XLogP value of 4.60104 indicates that propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate. Following Lipinski's Rule of Five, propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 5 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 propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate?
The CAS number of propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate is 445004-89-7.
What is the molecular formula of propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate?
The molecular formula of propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate is C18H20ClNO4S.
What is the molecular weight of propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate?
The molecular weight of propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate is 381.08 g/mol.
Where can I buy propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate?
You can request a quote for propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-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 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl 2-[[2-(2-chlorophenoxy)acetyl]amino]-4,5-dimethylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.