N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide
TL;DR: N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide (CAS 372978-52-4) is a chemical compound with molecular formula C18H16N6O6 and molecular weight 412.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-hydroxy-5-nitrophenyl)methylideneamino]-1,3,7-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
Also Known As: N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide, N-[(3-hydroxy-5-nitrophenyl)methylideneamino]-1,3,7-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
| Molecular Formula | C18H16N6O6 |
|---|---|
| Molecular Weight | 412.11 g/mol |
| LogP | 0.31832 |
| Topological Polar Surface Area | 161.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.11313 |
| Heavy Atoms | 30 |
| Complexity | 1353.9998 |
Chemical Identifiers
| CAS Number | 372978-52-4 |
|---|---|
| SMILES | CC1=C(C=C2C(=N1)N(C(=O)N(C2=O)C)C)C(=O)NN=CC3=CC(=CC(=C3)O)[N+](=O)[O-] |
Product Overview
N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide (CAS 372978-52-4), with molecular formula C18H16N6O6 and molecular weight 412.11 g/mol. IUPAC: N-[(3-hydroxy-5-nitrophenyl)methylideneamino]-1,3,7-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide.
Chemical Property Profile of N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide
Property Insights of N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide
The XLogP value of 0.31832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide. The TPSA of 161.72 Ų indicates high polarity, suggesting N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide has 2 hydrogen bond donor(s) and 8 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 N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide?
The CAS number of N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide is 372978-52-4.
What is the molecular formula of N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide?
The molecular formula of N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide is C18H16N6O6.
What is the molecular weight of N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide?
The molecular weight of N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide is 412.11 g/mol.
Where can I buy N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide?
You can request a quote for N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-(3-hydroxy-5-nitrobenzylidene)-1,3,7-trimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-6-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.