2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-(2-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-(2-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-(2-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-0188 |
| Compound Name: | 2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-(2-methoxyphenyl)-6-phenylpyridine-3-carbonitrile |
| Molecular Weight: | 443.61 |
| Molecular Formula: | C27 H29 N3 O S |
| Smiles: | COc1ccccc1c1cc(c2ccccc2)nc(c1C#N)SCCN1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.3333 |
| logD: | 5.3995 |
| logSw: | -5.6429 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.171 |
| InChI Key: | RHNILBICAZCEPZ-UHFFFAOYSA-N |