4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one
TL;DR: 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one (CAS 30805-31-3) is a chemical compound with molecular formula C9H10N4O and molecular weight 190.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one
Also Known As: 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one, 6-amino-4-phenyl-3,4-dihydro-1,3,5-triazin-2(1H)-one, TETRAHYDRO-4-IMINO-6-PHENYL-S-TRIAZIN-2(1H)-ONE, RefChem:289862
| Molecular Formula | C9H10N4O |
|---|---|
| Molecular Weight | 190.09 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.08546 |
| Heavy Atoms | 14 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 30805-31-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2NC(=O)NC(=N2)N |
| InChIKey | VLHIXZAPXFUAKW-UHFFFAOYSA-N |
Product Overview
4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one (CAS 30805-31-3), with molecular formula C9H10N4O and molecular weight 190.09 g/mol. IUPAC: 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one.
Chemical Property Profile of 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one
Property Insights of 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one. Following Lipinski's Rule of Five, 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one has 3 hydrogen bond donor(s) and 2 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 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one?
The CAS number of 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one is 30805-31-3.
What is the molecular formula of 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one?
The molecular formula of 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one is C9H10N4O.
What is the molecular weight of 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one?
The molecular weight of 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one is 190.09 g/mol.
Where can I buy 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one?
You can request a quote for 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 4-amino-2-phenyl-2,5-dihydro-1H-1,3,5-triazin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.