6-{[(4-chlorophenyl)methyl]sulfanyl}-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridine-7-carbonitrile
Chemical Structure Depiction of
6-{[(4-chlorophenyl)methyl]sulfanyl}-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridine-7-carbonitrile
6-{[(4-chlorophenyl)methyl]sulfanyl}-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridine-7-carbonitrile
Compound characteristics
| Compound ID: | 8017-6800 |
| Compound Name: | 6-{[(4-chlorophenyl)methyl]sulfanyl}-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridine-7-carbonitrile |
| Molecular Weight: | 341.86 |
| Molecular Formula: | C18 H16 Cl N3 S |
| Smiles: | C1CN2CCC1c1c2cc(C#N)c(n1)SCc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6925 |
| logD: | 4.6923 |
| logSw: | -5.0667 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.357 |
| InChI Key: | YDIQOOKRSFTDRO-UHFFFAOYSA-N |