BAS 11132680
TL;DR: BAS 11132680 (CAS 727403-47-6) is a chemical compound with molecular formula C19H22N4OS and molecular weight 354.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,6-dimethyl-9-(2-methylphenyl)-2-methylsulfanyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one
Also Known As: BAS 11132680, 6,6-dimethyl-9-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one, 6,6-dimethyl-2-(methylthio)-9-(o-tolyl)-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one, 6,6-DIMETHYL-9-(2-METHYLPHENYL)-2-(METHYLSULFANYL)-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE, 6,6-dimethyl-9-(2-methylphenyl)-2-(methylsulfanyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
| Molecular Formula | C19H22N4OS |
|---|---|
| Molecular Weight | 354.15 g/mol |
| LogP | 3.96652 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 354.15143 |
| Heavy Atoms | 25 |
| Complexity | 896.5791 |
Chemical Identifiers
| CAS Number | 727403-47-6 |
|---|---|
| SMILES | CC1=CC=CC=C1C2C3=C(CC(CC3=O)(C)C)NC4=NC(=NN24)SC |
Product Overview
BAS 11132680 (CAS 727403-47-6), with molecular formula C19H22N4OS and molecular weight 354.15 g/mol. IUPAC: 6,6-dimethyl-9-(2-methylphenyl)-2-methylsulfanyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one.
Chemical Property Profile of BAS 11132680
Property Insights of BAS 11132680
The XLogP value of 3.96652 indicates that BAS 11132680 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, BAS 11132680 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 11132680 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 BAS 11132680?
The CAS number of BAS 11132680 is 727403-47-6.
What is the molecular formula of BAS 11132680?
The molecular formula of BAS 11132680 is C19H22N4OS.
What is the molecular weight of BAS 11132680?
The molecular weight of BAS 11132680 is 354.15 g/mol.
Where can I buy BAS 11132680?
You can request a quote for BAS 11132680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11132680?
Yes, KEHONG BIO provides custom synthesis services for BAS 11132680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.