2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8003-6074 |
| Compound Name: | 2-{[(4-tert-butylphenyl)methyl]sulfanyl}-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile |
| Molecular Weight: | 398.57 |
| Molecular Formula: | C26 H26 N2 S |
| Smiles: | CC(C)(C)c1ccc(CSc2c(C#N)c(c3ccccc3)c3CCCc3n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 7.252 |
| logD: | 7.252 |
| logSw: | -6.0285 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.2862 |
| InChI Key: | VCVNGVDWNCTDKU-UHFFFAOYSA-N |