6-(4-bromophenyl)-2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-4-phenylpyridine-3-carbonitrile
Chemical Structure Depiction of
6-(4-bromophenyl)-2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-4-phenylpyridine-3-carbonitrile
6-(4-bromophenyl)-2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-4-phenylpyridine-3-carbonitrile
Compound characteristics
Compound ID: | 4378-0197 |
Compound Name: | 6-(4-bromophenyl)-2-{[2-(ethanesulfonyl)ethyl]sulfanyl}-4-phenylpyridine-3-carbonitrile |
Molecular Weight: | 487.44 |
Molecular Formula: | C22 H19 Br N2 O2 S2 |
Smiles: | CCS(CCSc1c(C#N)c(cc(c2ccc(cc2)[Br])n1)c1ccccc1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.604 |
logD: | 5.604 |
logSw: | -5.6411 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 53.799 |
InChI Key: | VODJRBUGNZTZGX-UHFFFAOYSA-N |