AB00686504-01
TL;DR: AB00686504-01 (CAS 874464-66-1) is a chemical compound with molecular formula C15H13F3N4OS and molecular weight 354.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide
Also Known As: AB00686504-01, F1787-0369, N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide, N-{5-[3-(trifluoromethyl)benzyl]-1,3-thiazol-2-yl}-4,5-dihydro-1H-imidazole-2-carboxamide, 2-imidazolin-2-yl-N-(5-{[3-(trifluoromethyl)phenyl]methyl}(1,3-thiazol-2-yl))c arboxamide
| Molecular Formula | C15H13F3N4OS |
|---|---|
| Molecular Weight | 354.08 g/mol |
| LogP | 2.6929 |
| Topological Polar Surface Area | 66.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.0762 |
| Heavy Atoms | 24 |
| Complexity | 785.0215 |
Chemical Identifiers
| CAS Number | 874464-66-1 |
|---|---|
| SMILES | C1CN=C(N1)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)C(F)(F)F |
Product Overview
AB00686504-01 (CAS 874464-66-1), with molecular formula C15H13F3N4OS and molecular weight 354.08 g/mol. IUPAC: N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-4,5-dihydro-1H-imidazole-2-carboxamide.
Chemical Property Profile of AB00686504-01
Property Insights of AB00686504-01
The XLogP value of 2.6929 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00686504-01. The TPSA of 66.38 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00686504-01. Following Lipinski's Rule of Five, AB00686504-01 has 2 hydrogen bond donor(s) and 5 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 AB00686504-01?
The CAS number of AB00686504-01 is 874464-66-1.
What is the molecular formula of AB00686504-01?
The molecular formula of AB00686504-01 is C15H13F3N4OS.
What is the molecular weight of AB00686504-01?
The molecular weight of AB00686504-01 is 354.08 g/mol.
Where can I buy AB00686504-01?
You can request a quote for AB00686504-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00686504-01?
Yes, KEHONG BIO provides custom synthesis services for AB00686504-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.