BAS 12918468
TL;DR: BAS 12918468 (CAS 878422-06-1) is a chemical compound with molecular formula C18H17N5O2S and molecular weight 367.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-hydroxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: BAS 12918468, N-(2-hydroxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide, N-(2-hydroxyphenyl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C18H17N5O2S |
|---|---|
| Molecular Weight | 367.11 g/mol |
| LogP | 2.9625 |
| Topological Polar Surface Area | 92.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 367.1103 |
| Heavy Atoms | 26 |
| Complexity | 910.9547 |
Chemical Identifiers
| CAS Number | 878422-06-1 |
|---|---|
| SMILES | C=CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2O)C3=CC=NC=C3 |
Product Overview
BAS 12918468 (CAS 878422-06-1), with molecular formula C18H17N5O2S and molecular weight 367.11 g/mol. IUPAC: N-(2-hydroxyphenyl)-2-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of BAS 12918468
Property Insights of BAS 12918468
The XLogP value of 2.9625 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12918468. The TPSA of 92.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12918468. Following Lipinski's Rule of Five, BAS 12918468 has 2 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 12918468?
The CAS number of BAS 12918468 is 878422-06-1.
What is the molecular formula of BAS 12918468?
The molecular formula of BAS 12918468 is C18H17N5O2S.
What is the molecular weight of BAS 12918468?
The molecular weight of BAS 12918468 is 367.11 g/mol.
Where can I buy BAS 12918468?
You can request a quote for BAS 12918468 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12918468?
Yes, KEHONG BIO provides custom synthesis services for BAS 12918468 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.