J3.074.651A
TL;DR: J3.074.651A (CAS 371132-08-0) is a chemical compound with molecular formula C18H18N4O6 and molecular weight 386.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1,3,7-trimethyl-5-(4-nitrophenyl)-2,4-dioxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate
Also Known As: J3.074.651A, AF-399/40756984, methyl 1,3,7-trimethyl-5-(4-nitrophenyl)-2,4-dioxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate, methyl 5-{4-nitrophenyl}-1,3,7-trimethyl-2,4-dioxo-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylate, 1,3,7-Trimethyl-2,4-dioxo-5-(4-nitrophenyl)-1,2,3,4,5,8-hexahydropyrido[2,3-d]pyrimidine-6-carboxylic acid methyl ester
| Molecular Formula | C18H18N4O6 |
|---|---|
| Molecular Weight | 386.12 g/mol |
| LogP | 0.9966 |
| Topological Polar Surface Area | 125.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.12262 |
| Heavy Atoms | 28 |
| Complexity | 1140.3914 |
Chemical Identifiers
| CAS Number | 371132-08-0 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)N(C(=O)N(C2=O)C)C)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC |
Product Overview
J3.074.651A (CAS 371132-08-0), with molecular formula C18H18N4O6 and molecular weight 386.12 g/mol. IUPAC: methyl 1,3,7-trimethyl-5-(4-nitrophenyl)-2,4-dioxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylate.
Chemical Property Profile of J3.074.651A
Property Insights of J3.074.651A
The XLogP value of 0.9966 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J3.074.651A. The TPSA of 125.47 Ų falls within the moderate polarity range, balancing permeability and solubility for J3.074.651A. Following Lipinski's Rule of Five, J3.074.651A has 1 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 J3.074.651A?
The CAS number of J3.074.651A is 371132-08-0.
What is the molecular formula of J3.074.651A?
The molecular formula of J3.074.651A is C18H18N4O6.
What is the molecular weight of J3.074.651A?
The molecular weight of J3.074.651A is 386.12 g/mol.
Where can I buy J3.074.651A?
You can request a quote for J3.074.651A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.074.651A?
Yes, KEHONG BIO provides custom synthesis services for J3.074.651A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.