3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
TL;DR: 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide (CAS 1023494-62-3) is a chemical compound with molecular formula C18H18ClFN2O2 and molecular weight 348.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
Also Known As: 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide, N-(1,1-DIETHYLPROP-2-YNYL)(3-(6-CHLORO-2-FLUOROPHENYL)-5-METHYLISOXAZOL-4-YL)FORMAMIDE, 3-(2-chloro-6-fluoro-phenyl)-N-(1,1-diethylprop-2-ynyl)-5-methyl-isoxazole-4-carboxamide, 3-(2-chloro-6-fluoro-phenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
| Molecular Formula | C18H18ClFN2O2 |
|---|---|
| Molecular Weight | 348.10 g/mol |
| LogP | 4.36432 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.1041 |
| Heavy Atoms | 24 |
| Complexity | 783.58545 |
Chemical Identifiers
| CAS Number | 1023494-62-3 |
|---|---|
| SMILES | CCC(CC)(C#C)NC(=O)C1=C(ON=C1C2=C(C=CC=C2Cl)F)C |
Product Overview
3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide (CAS 1023494-62-3), with molecular formula C18H18ClFN2O2 and molecular weight 348.10 g/mol. IUPAC: 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
Property Insights of 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide
The XLogP value of 4.36432 indicates that 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide has 1 hydrogen bond donor(s) and 3 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 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
The CAS number of 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide is 1023494-62-3.
What is the molecular formula of 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
The molecular formula of 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide is C18H18ClFN2O2.
What is the molecular weight of 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
The molecular weight of 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide is 348.10 g/mol.
Where can I buy 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
You can request a quote for 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-chloro-6-fluorophenyl)-N-(3-ethylpent-1-yn-3-yl)-5-methyl-1,2-oxazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.