AB00685418-01
TL;DR: AB00685418-01 (CAS 463958-16-9) is a chemical compound with molecular formula C13H16N6O and molecular weight 272.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2E)-2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-6-methyl-2H-1,2,4-triazin-3-one
Also Known As: AB00685418-01, F0919-4785, (E)-5-(2-(4-(dimethylamino)benzylidene)hydrazinyl)-6-methyl-1,2,4-triazin-3(2H)-one, 5-({(1E)-2-[4-(dimethylamino)phenyl]-1-azavinyl}amino)-6-methyl-2H-1,2,4-triaz in-3-one, (E)-2-{[p-(dimethylamino)phenyl]methylene}-1-(6-methyl-3-oxo-2,3-dihydro-1,2,4-triazin-5-yl)hydrazine
| Molecular Formula | C13H16N6O |
|---|---|
| Molecular Weight | 272.14 g/mol |
| LogP | 0.98532 |
| Topological Polar Surface Area | 86.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.13855 |
| Heavy Atoms | 20 |
| Complexity | 659.30676 |
Chemical Identifiers
| CAS Number | 463958-16-9 |
|---|---|
| SMILES | CC1=NNC(=O)N=C1N/N=C/C2=CC=C(C=C2)N(C)C |
Product Overview
AB00685418-01 (CAS 463958-16-9), with molecular formula C13H16N6O and molecular weight 272.14 g/mol. IUPAC: 5-[(2E)-2-[[4-(dimethylamino)phenyl]methylidene]hydrazinyl]-6-methyl-2H-1,2,4-triazin-3-one.
Chemical Property Profile of AB00685418-01
Property Insights of AB00685418-01
The XLogP value of 0.98532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00685418-01. The TPSA of 86.27 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685418-01. Following Lipinski's Rule of Five, AB00685418-01 has 2 hydrogen bond donor(s) and 6 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 AB00685418-01?
The CAS number of AB00685418-01 is 463958-16-9.
What is the molecular formula of AB00685418-01?
The molecular formula of AB00685418-01 is C13H16N6O.
What is the molecular weight of AB00685418-01?
The molecular weight of AB00685418-01 is 272.14 g/mol.
Where can I buy AB00685418-01?
You can request a quote for AB00685418-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685418-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685418-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.