6-(4-bromophenyl)-4-phenyl-2-{[2-(phenylmethanesulfinyl)ethyl]sulfanyl}pyridine-3-carbonitrile
Chemical Structure Depiction of
6-(4-bromophenyl)-4-phenyl-2-{[2-(phenylmethanesulfinyl)ethyl]sulfanyl}pyridine-3-carbonitrile
6-(4-bromophenyl)-4-phenyl-2-{[2-(phenylmethanesulfinyl)ethyl]sulfanyl}pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4378-0200 |
| Compound Name: | 6-(4-bromophenyl)-4-phenyl-2-{[2-(phenylmethanesulfinyl)ethyl]sulfanyl}pyridine-3-carbonitrile |
| Molecular Weight: | 533.51 |
| Molecular Formula: | C27 H21 Br N2 O S2 |
| Smiles: | C(CS(Cc1ccccc1)=O)Sc1c(C#N)c(cc(c2ccc(cc2)[Br])n1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.8916 |
| logD: | 6.8916 |
| logSw: | -6.4017 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.271 |
| InChI Key: | ANBMBEWCLGMXGA-UHFFFAOYSA-N |