![3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one structure](/static/products/3531/35315-52-7.webp)
3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one
TL;DR: 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one (CAS 35315-52-7) is a chemical compound with molecular formula C16H12N8O and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one
Also Known As: 3-[2-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4(3h)-one, 3-[2-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one, 1,2,3-Benzotriazin-4(3H)-one,3-[2-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]-, 3-[2-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotria, 1,2,3-Benzotriazin-4(3H)-one, 3-[2-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]-
| Molecular Formula | C16H12N8O |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.1134 |
| Heavy Atoms | 25 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 35315-52-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(N=N2)C3=CC=CC=C3C4=NC(=NC(=N4)N)N |
| InChIKey | IDNHJWYEWMTEJL-UHFFFAOYSA-N |
Product Overview
3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one (CAS 35315-52-7), with molecular formula C16H12N8O and molecular weight 332.11 g/mol. IUPAC: 3-[2-(4,6-diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one.
Chemical Property Profile of 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one
Property Insights of 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one. Following Lipinski's Rule of Five, 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one 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 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one?
The CAS number of 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one is 35315-52-7.
What is the molecular formula of 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one?
The molecular formula of 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one is C16H12N8O.
What is the molecular weight of 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one?
The molecular weight of 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one is 332.11 g/mol.
Where can I buy 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one?
You can request a quote for 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(4,6-Diamino-1,3,5-triazin-2-yl)phenyl]-1,2,3-benzotriazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.