AB00767591-01
TL;DR: AB00767591-01 (CAS 868154-93-2) is a chemical compound with molecular formula C16H16N4OS and molecular weight 312.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethanone
Also Known As: AB00767591-01, 2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethanone, 2-(5,7-dimethyl(8-hydro-1,2,4-triazolo[1,5-a]pyrimidin-2-ylthio))-1-(4-methylp henyl)ethan-1-one, 2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethanone
| Molecular Formula | C16H16N4OS |
|---|---|
| Molecular Weight | 312.10 g/mol |
| LogP | 3.02456 |
| Topological Polar Surface Area | 60.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.1045 |
| Heavy Atoms | 22 |
| Complexity | 839.22314 |
Chemical Identifiers
| CAS Number | 868154-93-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)CSC2=NN3C(=CC(=NC3=N2)C)C |
Product Overview
AB00767591-01 (CAS 868154-93-2), with molecular formula C16H16N4OS and molecular weight 312.10 g/mol. IUPAC: 2-[(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-1-(4-methylphenyl)ethanone.
Chemical Property Profile of AB00767591-01
Property Insights of AB00767591-01
The XLogP value of 3.02456 indicates that AB00767591-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.15 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00767591-01. Following Lipinski's Rule of Five, AB00767591-01 has 0 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 AB00767591-01?
The CAS number of AB00767591-01 is 868154-93-2.
What is the molecular formula of AB00767591-01?
The molecular formula of AB00767591-01 is C16H16N4OS.
What is the molecular weight of AB00767591-01?
The molecular weight of AB00767591-01 is 312.10 g/mol.
Where can I buy AB00767591-01?
You can request a quote for AB00767591-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00767591-01?
Yes, KEHONG BIO provides custom synthesis services for AB00767591-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.