![propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate structure](/static/products/4450/445020-53-1.webp)
propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate
TL;DR: propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate (CAS 445020-53-1) is a chemical compound with molecular formula C27H29NO3S and molecular weight 447.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate
Also Known As: propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate, isopropyl 4-(2,5-dimethylphenyl)-5-methyl-2-{[(2-phenylcyclopropyl)carbonyl]amino}-3-thiophenecarboxylate, methylethyl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropyl)carbonylam ino]thiophene-3-carboxylate, propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-{[(2-phenylcyclopropyl)carbonyl]amino}thiophene-3-carboxylate
| Molecular Formula | C27H29NO3S |
|---|---|
| Molecular Weight | 447.19 g/mol |
| LogP | 6.64776 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.18683 |
| Heavy Atoms | 32 |
| Complexity | 1163.1447 |
Chemical Identifiers
| CAS Number | 445020-53-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C2=C(SC(=C2C(=O)OC(C)C)NC(=O)C3CC3C4=CC=CC=C4)C |
Product Overview
propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate (CAS 445020-53-1), with molecular formula C27H29NO3S and molecular weight 447.19 g/mol. IUPAC: propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate
Property Insights of propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate
The XLogP value of 6.64776 indicates that propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 4 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 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate?
The CAS number of propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate is 445020-53-1.
What is the molecular formula of propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate?
The molecular formula of propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate is C27H29NO3S.
What is the molecular weight of propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate?
The molecular weight of propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate is 447.19 g/mol.
Where can I buy propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate?
You can request a quote for propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)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 propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl 4-(2,5-dimethylphenyl)-5-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.