![propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate structure](/static/products/5148/514837-75-3.webp)
propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate
TL;DR: propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate (CAS 514837-75-3) is a chemical compound with molecular formula C31H31ClN2O4S and molecular weight 562.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate
Also Known As: propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate, isopropyl 2-({[3-(2-chlorophenyl)-5-methylisoxazol-4-yl]carbonyl}amino)-4-(4-cyclohexylphenyl)thiophene-3-carboxylate, methylethyl 2-{[3-(2-chlorophenyl)-5-methylisoxazol-4-yl]carbonylamino}-4-(4-c yclohexylphenyl)thiophene-3-carboxylate, propan-2-yl 2-({[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}amino)-4-(4-cyclohexylphenyl)thiophene-3-carboxylate
| Molecular Formula | C31H31ClN2O4S |
|---|---|
| Molecular Weight | 562.17 g/mol |
| LogP | 8.89712 |
| Topological Polar Surface Area | 81.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 562.1693 |
| Heavy Atoms | 39 |
| Complexity | 1482.7443 |
Chemical Identifiers
| CAS Number | 514837-75-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)C5CCCCC5)C(=O)OC(C)C |
Product Overview
propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate (CAS 514837-75-3), with molecular formula C31H31ClN2O4S and molecular weight 562.17 g/mol. IUPAC: propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate.
Chemical Property Profile of propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate
Property Insights of propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate
The XLogP value of 8.89712 indicates that propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.43 Ų falls within the moderate polarity range, balancing permeability and solubility for propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate. Following Lipinski's Rule of Five, propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate has 1 hydrogen bond donor(s) and 6 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 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate?
The CAS number of propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate is 514837-75-3.
What is the molecular formula of propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate?
The molecular formula of propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate is C31H31ClN2O4S.
What is the molecular weight of propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate?
The molecular weight of propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate is 562.17 g/mol.
Where can I buy propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate?
You can request a quote for propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)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 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl 2-[[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino]-4-(4-cyclohexylphenyl)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.