![4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one structure](/static/products/6945/694507-77-2.webp)
4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one
TL;DR: 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one (CAS 694507-77-2) is a chemical compound with molecular formula C12H15N5O and molecular weight 245.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-6-methyl-3-(2-phenylethylamino)-1,2,4-triazin-5-one
Also Known As: ChemDiv3_006276, IDI1_024186, 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one, BAS 06970484, 4-amino-6-methyl-3-(phenethylamino)-1,2,4-triazin-5(4H)-one
| Molecular Formula | C12H15N5O |
|---|---|
| Molecular Weight | 245.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.12766 |
| Heavy Atoms | 18 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 694507-77-2 |
|---|---|
| SMILES | CC1=NN=C(N(C1=O)N)NCCC2=CC=CC=C2 |
| InChIKey | JUKCAZNRXXXWQP-UHFFFAOYSA-N |
Product Overview
4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one (CAS 694507-77-2), with molecular formula C12H15N5O and molecular weight 245.13 g/mol. IUPAC: 4-amino-6-methyl-3-(2-phenylethylamino)-1,2,4-triazin-5-one.
Chemical Property Profile of 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one
Property Insights of 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one. Following Lipinski's Rule of Five, 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one has 2 hydrogen bond donor(s) and 4 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-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one?
The CAS number of 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one is 694507-77-2.
What is the molecular formula of 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one?
The molecular formula of 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one is C12H15N5O.
What is the molecular weight of 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one?
The molecular weight of 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one is 245.13 g/mol.
Where can I buy 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one?
You can request a quote for 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-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-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-6-methyl-3-phenethylamino-4H-[1,2,4]triazin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.