BAS 11132740
TL;DR: BAS 11132740 (CAS 727403-99-8) is a chemical compound with molecular formula C21H26N4O3S and molecular weight 414.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(3-ethoxy-4-hydroxyphenyl)-2-ethylsulfanyl-6,6-dimethyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one
Also Known As: BAS 11132740, 9-(3-ethoxy-4-hydroxyphenyl)-2-(ethylsulfanyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one, 9-(3-ETHOXY-4-HYDROXYPHENYL)-2-(ETHYLSULFANYL)-6,6-DIMETHYL-4H,5H,6H,7H,8H,9H-[1,2,4]TRIAZOLO[3,2-B]QUINAZOLIN-8-ONE, 9-(3-ethoxy-4-hydroxyphenyl)-2-(ethylsulfanyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol, 9-(3-ethoxy-4-hydroxyphenyl)-2-(ethylthio)-6,6-dimethyl-5,6,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
| Molecular Formula | C21H26N4O3S |
|---|---|
| Molecular Weight | 414.17 g/mol |
| LogP | 4.1525 |
| Topological Polar Surface Area | 89.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.17258 |
| Heavy Atoms | 29 |
| Complexity | 995.80756 |
Chemical Identifiers
| CAS Number | 727403-99-8 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=NC(=NN24)SCC)O |
Product Overview
BAS 11132740 (CAS 727403-99-8), with molecular formula C21H26N4O3S and molecular weight 414.17 g/mol. IUPAC: 9-(3-ethoxy-4-hydroxyphenyl)-2-ethylsulfanyl-6,6-dimethyl-4,5,7,9-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-8-one.
Chemical Property Profile of BAS 11132740
Property Insights of BAS 11132740
The XLogP value of 4.1525 indicates that BAS 11132740 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11132740. Following Lipinski's Rule of Five, BAS 11132740 has 2 hydrogen bond donor(s) and 7 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 11132740?
The CAS number of BAS 11132740 is 727403-99-8.
What is the molecular formula of BAS 11132740?
The molecular formula of BAS 11132740 is C21H26N4O3S.
What is the molecular weight of BAS 11132740?
The molecular weight of BAS 11132740 is 414.17 g/mol.
Where can I buy BAS 11132740?
You can request a quote for BAS 11132740 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11132740?
Yes, KEHONG BIO provides custom synthesis services for BAS 11132740 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.