AB00083914-01
TL;DR: AB00083914-01 (CAS 313688-49-2) is a chemical compound with molecular formula C17H11ClFN3O3 and molecular weight 359.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-5-[(4-fluorophenyl)iminomethyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: AB00083914-01, (5Z)-1-(4-chlorophenyl)-5-[(4-fluoroanilino)methylidene]-1,3-diazinane-2,4,6-trione, (5E)-1-(4-chlorophenyl)-5-[(4-fluoroanilino)methylidene]-1,3-diazinane-2,4,6-trione, 1-(4-chlorophenyl)-5-[(4-fluoroanilino)methylidene]-1,3-diazinane-2,4,6-trione, (5Z)-3-(4-chlorophenyl)-5-{[(4-fluorophenyl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C17H11ClFN3O3 |
|---|---|
| Molecular Weight | 359.05 g/mol |
| LogP | 2.7745 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 359.0473 |
| Heavy Atoms | 25 |
| Complexity | 1054.4816 |
Chemical Identifiers
| CAS Number | 313688-49-2 |
|---|---|
| SMILES | C1=CC(=CC=C1N=CC2=C(N(C(=O)NC2=O)C3=CC=C(C=C3)Cl)O)F |
Product Overview
AB00083914-01 (CAS 313688-49-2), with molecular formula C17H11ClFN3O3 and molecular weight 359.05 g/mol. IUPAC: 1-(4-chlorophenyl)-5-[(4-fluorophenyl)iminomethyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of AB00083914-01
Property Insights of AB00083914-01
The XLogP value of 2.7745 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00083914-01. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00083914-01. Following Lipinski's Rule of Five, AB00083914-01 has 2 hydrogen bond donor(s) and 4 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 AB00083914-01?
The CAS number of AB00083914-01 is 313688-49-2.
What is the molecular formula of AB00083914-01?
The molecular formula of AB00083914-01 is C17H11ClFN3O3.
What is the molecular weight of AB00083914-01?
The molecular weight of AB00083914-01 is 359.05 g/mol.
Where can I buy AB00083914-01?
You can request a quote for AB00083914-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00083914-01?
Yes, KEHONG BIO provides custom synthesis services for AB00083914-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.