isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate
TL;DR: isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate (CAS 438214-31-4) is a chemical compound with molecular formula C29H32N2O6S and molecular weight 536.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[(4-cyclopentyloxybenzoyl)amino]-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
Also Known As: isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate, propan-2-yl 2-[(4-cyclopentyloxybenzoyl)amino]-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate, isopropyl 2-(4-(cyclopentyloxy)benzamido)-5-((2-methoxyphenyl)carbamoyl)-4-methylthiophene-3-carboxylate, methylethyl 2-[(4-cyclopentyloxyphenyl)carbonylamino]-5-[N-(2-methoxyphenyl)ca rbamoyl]-4-methylthiophene-3-carboxylate, propan-2-yl 2-({[4-(cyclopentyloxy)phenyl]carbonyl}amino)-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
| Molecular Formula | C29H32N2O6S |
|---|---|
| Molecular Weight | 536.20 g/mol |
| LogP | 6.45632 |
| Topological Polar Surface Area | 102.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 536.1981 |
| Heavy Atoms | 38 |
| Complexity | 1309.1025 |
Chemical Identifiers
| CAS Number | 438214-31-4 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CC=C(C=C2)OC3CCCC3)C(=O)NC4=CC=CC=C4OC |
Product Overview
isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate (CAS 438214-31-4), with molecular formula C29H32N2O6S and molecular weight 536.20 g/mol. IUPAC: propan-2-yl 2-[(4-cyclopentyloxybenzoyl)amino]-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate
Property Insights of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate
The XLogP value of 6.45632 indicates that isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.96 Ų falls within the moderate polarity range, balancing permeability and solubility for isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate. Following Lipinski's Rule of Five, isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate?
The CAS number of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate is 438214-31-4.
What is the molecular formula of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate?
The molecular formula of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate is C29H32N2O6S.
What is the molecular weight of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate?
The molecular weight of isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate is 536.20 g/mol.
Where can I buy isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate?
You can request a quote for isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl 2-{[4-(cyclopentyloxy)benzoyl]amino}-5-[(2-methoxyanilino)carbonyl]-4-methyl-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.