2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 1404-0086 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-cyclopropyl-4-(4-methoxyphenyl)pyridine-3-carbonitrile |
| Molecular Weight: | 479.39 |
| Molecular Formula: | C24 H19 Br N2 O2 S |
| Smiles: | COc1ccc(cc1)c1cc(C2CC2)nc(c1C#N)SCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.6327 |
| logD: | 6.6327 |
| logSw: | -5.7367 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.541 |
| InChI Key: | RCWLGZQBGRRKIM-UHFFFAOYSA-N |