AB00685704-01
TL;DR: AB00685704-01 (CAS 683779-00-2) is a chemical compound with molecular formula C18H16FN3O4 and molecular weight 357.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 5-(4-fluorophenyl)-7-methyl-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate
Also Known As: AB00685704-01, F1168-0156, allyl 5-(4-fluorophenyl)-7-methyl-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate, prop-2-en-1-yl 5-(4-fluorophenyl)-7-methyl-2,4-dioxo-1H,2H,3H,4H,5H,8H-pyrido[2,3-d]pyrimidine-6-carboxylate, prop-2-enyl 5-(4-fluorophenyl)-7-methyl-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate
| Molecular Formula | C18H16FN3O4 |
|---|---|
| Molecular Weight | 357.11 g/mol |
| LogP | 1.7629 |
| Topological Polar Surface Area | 104.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.1125 |
| Heavy Atoms | 26 |
| Complexity | 1017.9671 |
Chemical Identifiers
| CAS Number | 683779-00-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)NC(=O)NC2=O)C3=CC=C(C=C3)F)C(=O)OCC=C |
Product Overview
AB00685704-01 (CAS 683779-00-2), with molecular formula C18H16FN3O4 and molecular weight 357.11 g/mol. IUPAC: prop-2-enyl 5-(4-fluorophenyl)-7-methyl-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of AB00685704-01
Property Insights of AB00685704-01
The XLogP value of 1.7629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00685704-01. The TPSA of 104.05 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685704-01. Following Lipinski's Rule of Five, AB00685704-01 has 3 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 AB00685704-01?
The CAS number of AB00685704-01 is 683779-00-2.
What is the molecular formula of AB00685704-01?
The molecular formula of AB00685704-01 is C18H16FN3O4.
What is the molecular weight of AB00685704-01?
The molecular weight of AB00685704-01 is 357.11 g/mol.
Where can I buy AB00685704-01?
You can request a quote for AB00685704-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685704-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685704-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.