2-{[(4-chlorophenyl)methyl]sulfanyl}-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
2-{[(4-chlorophenyl)methyl]sulfanyl}-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | D360-5961 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 300.81 |
| Molecular Formula: | C16 H13 Cl N2 S |
| Smiles: | C1Cc2cc(C#N)c(nc2C1)SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4584 |
| logD: | 4.4584 |
| logSw: | -4.8367 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.5577 |
| InChI Key: | JVRAPPJDVWCHQM-UHFFFAOYSA-N |