![isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate structure](/static/products/4452/445232-89-3.webp)
isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate
TL;DR: isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate (CAS 445232-89-3) is a chemical compound with molecular formula C22H23NO3S2 and molecular weight 413.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-(3-methylphenyl)thiophene-3-carboxylate
Also Known As: isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate, propan-2-yl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-(3-methylphenyl)thiophene-3-carboxylate, isopropyl 2-(4,5-dimethylthiophene-3-carboxamido)-4-(m-tolyl)thiophene-3-carboxylate, methylethyl 2-[(4,5-dimethyl(3-thienyl))carbonylamino]-4-(3-methylphenyl)thiop hene-3-carboxylate, propan-2-yl 2-{[(4,5-dimethylthiophen-3-yl)carbonyl]amino}-4-(3-methylphenyl)thiophene-3-carboxylate
| Molecular Formula | C22H23NO3S2 |
|---|---|
| Molecular Weight | 413.11 g/mol |
| LogP | 6.21936 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.11194 |
| Heavy Atoms | 28 |
| Complexity | 1030.334 |
Chemical Identifiers
| CAS Number | 445232-89-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=CSC(=C2C(=O)OC(C)C)NC(=O)C3=CSC(=C3C)C |
Product Overview
isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate (CAS 445232-89-3), with molecular formula C22H23NO3S2 and molecular weight 413.11 g/mol. IUPAC: propan-2-yl 2-[(4,5-dimethylthiophene-3-carbonyl)amino]-4-(3-methylphenyl)thiophene-3-carboxylate.
Chemical Property Profile of isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate
Property Insights of isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate
The XLogP value of 6.21936 indicates that isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate has 1 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 isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate?
The CAS number of isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate is 445232-89-3.
What is the molecular formula of isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate?
The molecular formula of isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate is C22H23NO3S2.
What is the molecular weight of isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate?
The molecular weight of isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate is 413.11 g/mol.
Where can I buy isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate?
You can request a quote for isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-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-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for isopropyl 2-{[(4,5-dimethyl-3-thienyl)carbonyl]amino}-4-(3-methylphenyl)-3-thiophenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.