F1057-0594
TL;DR: F1057-0594 (CAS 324045-91-2) is a chemical compound with molecular formula C16H14N4O6 and molecular weight 358.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate
Also Known As: F1057-0594, methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate, methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate, METHYL 7-METHYL-5-(3-NITROPHENYL)-2,4-DIOXO-1H,2H,3H,4H,5H,8H-PYRIDO[2,3-D]PYRIMIDINE-6-CARBOXYLATE
| Molecular Formula | C16H14N4O6 |
|---|---|
| Molecular Weight | 358.09 g/mol |
| LogP | 0.9758 |
| Topological Polar Surface Area | 147.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 358.09134 |
| Heavy Atoms | 26 |
| Complexity | 1064.895 |
Chemical Identifiers
| CAS Number | 324045-91-2 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)NC(=O)NC2=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC |
Product Overview
F1057-0594 (CAS 324045-91-2), with molecular formula C16H14N4O6 and molecular weight 358.09 g/mol. IUPAC: methyl 7-methyl-5-(3-nitrophenyl)-2,4-dioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of F1057-0594
Property Insights of F1057-0594
The XLogP value of 0.9758 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1057-0594. The TPSA of 147.19 Ų indicates high polarity, suggesting F1057-0594 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F1057-0594 has 3 hydrogen bond donor(s) and 7 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 F1057-0594?
The CAS number of F1057-0594 is 324045-91-2.
What is the molecular formula of F1057-0594?
The molecular formula of F1057-0594 is C16H14N4O6.
What is the molecular weight of F1057-0594?
The molecular weight of F1057-0594 is 358.09 g/mol.
Where can I buy F1057-0594?
You can request a quote for F1057-0594 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1057-0594?
Yes, KEHONG BIO provides custom synthesis services for F1057-0594 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.