AB00672234-01
TL;DR: AB00672234-01 (CAS 887899-23-2) is a chemical compound with molecular formula C18H11F4N3O3 and molecular weight 393.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxamide
Also Known As: AB00672234-01, F0696-0493, 3-(4-fluorophenyl)-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxamide, 3-(4-fluorophenyl)-2,4-dioxo-N-(3-(trifluoromethyl)phenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxamide, 3-(4-fluorophenyl)-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydropyrimidine-5-carboxamide
| Molecular Formula | C18H11F4N3O3 |
|---|---|
| Molecular Weight | 393.07 g/mol |
| LogP | 2.936 |
| Topological Polar Surface Area | 83.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 393.07364 |
| Heavy Atoms | 28 |
| Complexity | 1148.2179 |
Chemical Identifiers
| CAS Number | 887899-23-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)C2=CNC(=O)N(C2=O)C3=CC=C(C=C3)F)C(F)(F)F |
Product Overview
AB00672234-01 (CAS 887899-23-2), with molecular formula C18H11F4N3O3 and molecular weight 393.07 g/mol. IUPAC: 3-(4-fluorophenyl)-2,4-dioxo-N-[3-(trifluoromethyl)phenyl]-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of AB00672234-01
Property Insights of AB00672234-01
The XLogP value of 2.936 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00672234-01. The TPSA of 83.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672234-01. Following Lipinski's Rule of Five, AB00672234-01 has 2 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 AB00672234-01?
The CAS number of AB00672234-01 is 887899-23-2.
What is the molecular formula of AB00672234-01?
The molecular formula of AB00672234-01 is C18H11F4N3O3.
What is the molecular weight of AB00672234-01?
The molecular weight of AB00672234-01 is 393.07 g/mol.
Where can I buy AB00672234-01?
You can request a quote for AB00672234-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672234-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672234-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.