BAS 10189263
TL;DR: BAS 10189263 (CAS 831206-11-2) is a chemical compound with molecular formula C20H18N6O3S and molecular weight 422.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-hydroxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
Also Known As: BAS 10189263, 2-((4-allyl-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-oxo-2,3-dihydro-1H-benzo[d]imidazol-5-yl)acetamide, 2-[[(5Z)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-prop-2-enyl-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide, 2-[[5-(6-oxocyclohexa-2,4-dien-1-ylidene)-4-prop-2-enyl-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide, 2-{[4-allyl-5-(2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]thio}-N-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)acetamide
| Molecular Formula | C20H18N6O3S |
|---|---|
| Molecular Weight | 422.12 g/mol |
| LogP | 2.7371 |
| Topological Polar Surface Area | 128.69 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.11612 |
| Heavy Atoms | 30 |
| Complexity | 1289.1816 |
Chemical Identifiers
| CAS Number | 831206-11-2 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C4=CC=CC=C4O |
Product Overview
BAS 10189263 (CAS 831206-11-2), with molecular formula C20H18N6O3S and molecular weight 422.12 g/mol. IUPAC: 2-[[5-(2-hydroxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide.
Chemical Property Profile of BAS 10189263
Property Insights of BAS 10189263
The XLogP value of 2.7371 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10189263. The TPSA of 128.69 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10189263. Following Lipinski's Rule of Five, BAS 10189263 has 4 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 10189263?
The CAS number of BAS 10189263 is 831206-11-2.
What is the molecular formula of BAS 10189263?
The molecular formula of BAS 10189263 is C20H18N6O3S.
What is the molecular weight of BAS 10189263?
The molecular weight of BAS 10189263 is 422.12 g/mol.
Where can I buy BAS 10189263?
You can request a quote for BAS 10189263 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10189263?
Yes, KEHONG BIO provides custom synthesis services for BAS 10189263 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.