AB00672236-01
TL;DR: AB00672236-01 (CAS 887899-52-7) is a chemical compound with molecular formula C17H11FN4O5 and molecular weight 370.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-N-(4-nitrophenyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
Also Known As: AB00672236-01, F0696-0501, 3-(4-fluorophenyl)-N-(4-nitrophenyl)-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, 3-(4-fluorophenyl)-N-(4-nitrophenyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide, N-p-nitrophenyl-3-(p-fluorophenyl)-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
| Molecular Formula | C17H11FN4O5 |
|---|---|
| Molecular Weight | 370.07 g/mol |
| LogP | 1.8254 |
| Topological Polar Surface Area | 127.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.07135 |
| Heavy Atoms | 27 |
| Complexity | 1133.7256 |
Chemical Identifiers
| CAS Number | 887899-52-7 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C2=CNC(=O)N(C2=O)C3=CC=C(C=C3)F)[N+](=O)[O-] |
Product Overview
AB00672236-01 (CAS 887899-52-7), with molecular formula C17H11FN4O5 and molecular weight 370.07 g/mol. IUPAC: 3-(4-fluorophenyl)-N-(4-nitrophenyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of AB00672236-01
Property Insights of AB00672236-01
The XLogP value of 1.8254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00672236-01. The TPSA of 127.1 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00672236-01. Following Lipinski's Rule of Five, AB00672236-01 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 AB00672236-01?
The CAS number of AB00672236-01 is 887899-52-7.
What is the molecular formula of AB00672236-01?
The molecular formula of AB00672236-01 is C17H11FN4O5.
What is the molecular weight of AB00672236-01?
The molecular weight of AB00672236-01 is 370.07 g/mol.
Where can I buy AB00672236-01?
You can request a quote for AB00672236-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00672236-01?
Yes, KEHONG BIO provides custom synthesis services for AB00672236-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.