![3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione structure](/static/products/422/42285-77-8.png)
3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione
TL;DR: 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione (CAS 42285-77-8) is a chemical compound with molecular formula C12H8ClN5O2 and molecular weight 289.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-6-methyl-8H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
Also Known As: J1.847.909E, D052-0151, 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione, 3-(4-CHLOROPHENYL)-6-METHYL-5H,6H,7H,8H-PYRIMIDO[5,4-E][1,2,4]TRIAZINE-5,7-DIONE, 3-(4-Chlorophenyl)-6-methyl-5,6,7,8-tetrahydropyrimido[5,4-e]-1,2,4-triazine-5,7-dione
| Molecular Formula | C12H8ClN5O2 |
|---|---|
| Molecular Weight | 289.04 g/mol |
| LogP | 0.7322 |
| Topological Polar Surface Area | 93.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 289.03665 |
| Heavy Atoms | 20 |
| Complexity | 913.7644 |
Chemical Identifiers
| CAS Number | 42285-77-8 |
|---|---|
| SMILES | CN1C(=O)C2=C(NC1=O)N=NC(=N2)C3=CC=C(C=C3)Cl |
Product Overview
3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione (CAS 42285-77-8), with molecular formula C12H8ClN5O2 and molecular weight 289.04 g/mol. IUPAC: 3-(4-chlorophenyl)-6-methyl-8H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione.
Chemical Property Profile of 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione
Property Insights of 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione
The XLogP value of 0.7322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione. The TPSA of 93.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione. Following Lipinski's Rule of Five, 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione has 1 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 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione?
The CAS number of 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione is 42285-77-8.
What is the molecular formula of 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione?
The molecular formula of 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione is C12H8ClN5O2.
What is the molecular weight of 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione?
The molecular weight of 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione is 289.04 g/mol.
Where can I buy 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione?
You can request a quote for 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-chlorophenyl)-6-methylpyrimido[5,4-e][1,2,4]triazine-5,7(6H,8H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.