2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 8003-4511 |
| Compound Name: | 2-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-phenyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 408.92 |
| Molecular Formula: | C23 H18 Cl F N2 S |
| Smiles: | C1CCc2c(C1)c(c1ccccc1)c(C#N)c(n2)SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 6.9958 |
| logD: | 6.9958 |
| logSw: | -6.8722 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.9202 |
| InChI Key: | WOPBXZQXELXZNY-UHFFFAOYSA-N |