7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione
TL;DR: 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione (CAS 674354-35-9) is a chemical compound with molecular formula C15H13N7O4 and molecular weight 355.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione
Also Known As: 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione, 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione, 7,9-dimethyl-3-(3-nitrophenyl)-7,9-dihydro-[1,2,4]triazino[3,4-f]purine-6,8(1H,4H)-dione
| Molecular Formula | C15H13N7O4 |
|---|---|
| Molecular Weight | 355.10 g/mol |
| LogP | 0.1717 |
| Topological Polar Surface Area | 129.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 355.1029 |
| Heavy Atoms | 26 |
| Complexity | 1231.2463 |
Chemical Identifiers
| CAS Number | 674354-35-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N3CC(=NNC3=N2)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione (CAS 674354-35-9), with molecular formula C15H13N7O4 and molecular weight 355.10 g/mol. IUPAC: 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione.
Chemical Property Profile of 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione
Property Insights of 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione
The XLogP value of 0.1717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione. The TPSA of 129.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione. Following Lipinski's Rule of Five, 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione 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 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione?
The CAS number of 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione is 674354-35-9.
What is the molecular formula of 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione?
The molecular formula of 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione is C15H13N7O4.
What is the molecular weight of 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione?
The molecular weight of 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione is 355.10 g/mol.
Where can I buy 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione?
You can request a quote for 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 7,9-dimethyl-3-(3-nitrophenyl)-1,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.