2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one
TL;DR: 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one (CAS 130747-43-2) is a chemical compound with molecular formula C9H6N4O2 and molecular weight 202.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one
Also Known As: 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one, BAS 03181362, 2-Amino-9-oxa-1,3,4a-triaza-fluoren-4-one, 2-Amino-4H-s-triazino[2,1-b]benzoxazole-4-one, AJ-292/40762789
| Molecular Formula | C9H6N4O2 |
|---|---|
| Molecular Weight | 202.05 g/mol |
| LogP | 0.4179 |
| Topological Polar Surface Area | 86.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 202.04907 |
| Heavy Atoms | 15 |
| Complexity | 712.77264 |
Chemical Identifiers
| CAS Number | 130747-43-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C(=NC(=NC3=O)N)O2 |
Product Overview
2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one (CAS 130747-43-2), with molecular formula C9H6N4O2 and molecular weight 202.05 g/mol. IUPAC: 2-amino-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one.
Chemical Property Profile of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one
Property Insights of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one
The XLogP value of 0.4179 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one. The TPSA of 86.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one. Following Lipinski's Rule of Five, 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one 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 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one?
The CAS number of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one is 130747-43-2.
What is the molecular formula of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one?
The molecular formula of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one is C9H6N4O2.
What is the molecular weight of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one?
The molecular weight of 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one is 202.05 g/mol.
Where can I buy 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one?
You can request a quote for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-4H-[1,3,5]triazino[2,1-b][1,3]benzoxazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.