2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile
TL;DR: 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile (CAS 1426536-91-5) is a chemical compound with molecular formula C14H10N2O2S and molecular weight 270.0463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-2-(benzenesulfonyl)-3-pyridin-3-ylprop-2-enenitrile
Also Known As: 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile, 2-(benzenesulfonyl)-3-(pyridin-3-yl)prop-2-enenitrile, (E)-2-(benzenesulfonyl)-3-pyridin-3-ylprop-2-enenitrile, 2-(benzenesulfonyl)-3-pyridin-3-yl-prop-2-enenitrile, (2E)-2-(phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile
Technical Specifications
| Molecular Formula | C14H10N2O2S |
| Molecular Weight | 270.0463 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 79.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.0463 Da |
| Heavy Atoms | 19 |
| Complexity | 475.0 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)/C(=C/C2=CN=CC=C2)/C#N |
| InChIKey | NRQRQNPEJRBKDO-NTEUORMPSA-N |
Chemical Property Profile of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile
Property Insights of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile. Following Lipinski's Rule of Five, 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile?
The CAS number of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile is 1426536-91-5.
What is the molecular formula of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile?
The molecular formula of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile is C14H10N2O2S.
What is the molecular weight of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile?
The molecular weight of 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile is 270.0463 g/mol.
Where can I buy 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile?
You can request a quote for 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for 2-(Phenylsulfonyl)-3-(3-pyridyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.