AB00110652-01
TL;DR: AB00110652-01 (CAS 429627-12-3) is a chemical compound with molecular formula C20H18ClFN2O2 and molecular weight 372.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-6-fluorophenyl)-5-methyl-N-(4-propan-2-ylphenyl)-1,2-oxazole-4-carboxamide
Also Known As: AB00110652-01, 3-(2-chloro-6-fluorophenyl)-5-methyl-N-(4-propan-2-ylphenyl)-1,2-oxazole-4-carboxamide, 3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(propan-2-yl)phenyl]-1,2-oxazole-4-carboxamide, 3-(2-chloro-6-fluorophenyl)-N-(4-isopropylphenyl)-5-methylisoxazole-4-carboxamide
| Molecular Formula | C20H18ClFN2O2 |
|---|---|
| Molecular Weight | 372.10 g/mol |
| LogP | 5.81822 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.1041 |
| Heavy Atoms | 26 |
| Complexity | 928.69507 |
Chemical Identifiers
| CAS Number | 429627-12-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NC3=CC=C(C=C3)C(C)C |
Product Overview
AB00110652-01 (CAS 429627-12-3), with molecular formula C20H18ClFN2O2 and molecular weight 372.10 g/mol. IUPAC: 3-(2-chloro-6-fluorophenyl)-5-methyl-N-(4-propan-2-ylphenyl)-1,2-oxazole-4-carboxamide.
Chemical Property Profile of AB00110652-01
Property Insights of AB00110652-01
The XLogP value of 5.81822 indicates that AB00110652-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, AB00110652-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00110652-01 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00110652-01?
The CAS number of AB00110652-01 is 429627-12-3.
What is the molecular formula of AB00110652-01?
The molecular formula of AB00110652-01 is C20H18ClFN2O2.
What is the molecular weight of AB00110652-01?
The molecular weight of AB00110652-01 is 372.10 g/mol.
Where can I buy AB00110652-01?
You can request a quote for AB00110652-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00110652-01?
Yes, KEHONG BIO provides custom synthesis services for AB00110652-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.