BAS 11132498
TL;DR: BAS 11132498 (CAS 727402-14-4) is a chemical compound with molecular formula C16H18N4OS2 and molecular weight 346.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro-4H-[1,2,4]triazolo[5,1-b]quinazolin-8-one
Also Known As: BAS 11132498, 2-(ethylsulfanyl)-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol, 2-(ETHYLSULFANYL)-9-(3-METHYLTHIOPHEN-2-YL)-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE, 2-(ethylthio)-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one, 2-ethylsulfanyl-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-8-one
| Molecular Formula | C16H18N4OS2 |
|---|---|
| Molecular Weight | 346.09 g/mol |
| LogP | 3.78202 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.0922 |
| Heavy Atoms | 23 |
| Complexity | 804.86224 |
Chemical Identifiers
| CAS Number | 727402-14-4 |
|---|---|
| SMILES | CCSC1=NN2C(C3=C(CCCC3=O)NC2=N1)C4=C(C=CS4)C |
Product Overview
BAS 11132498 (CAS 727402-14-4), with molecular formula C16H18N4OS2 and molecular weight 346.09 g/mol. IUPAC: 2-ethylsulfanyl-9-(3-methylthiophen-2-yl)-5,6,7,9-tetrahydro-4H-[1,2,4]triazolo[5,1-b]quinazolin-8-one.
Chemical Property Profile of BAS 11132498
Property Insights of BAS 11132498
The XLogP value of 3.78202 indicates that BAS 11132498 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 11132498 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 11132498 has 1 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 BAS 11132498?
The CAS number of BAS 11132498 is 727402-14-4.
What is the molecular formula of BAS 11132498?
The molecular formula of BAS 11132498 is C16H18N4OS2.
What is the molecular weight of BAS 11132498?
The molecular weight of BAS 11132498 is 346.09 g/mol.
Where can I buy BAS 11132498?
You can request a quote for BAS 11132498 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11132498?
Yes, KEHONG BIO provides custom synthesis services for BAS 11132498 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.