2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-[4-(octyloxy)phenyl]prop-2-enenitrile
Chemical Structure Depiction of
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-[4-(octyloxy)phenyl]prop-2-enenitrile
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-[4-(octyloxy)phenyl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 1246-0662 |
| Compound Name: | 2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-[4-(octyloxy)phenyl]prop-2-enenitrile |
| Molecular Weight: | 451.03 |
| Molecular Formula: | C26 H27 Cl N2 O S |
| Smiles: | CCCCCCCCOc1ccc(\C=C(/C#N)c2nc(cs2)c2ccc(cc2)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 9.5022 |
| logD: | 9.5022 |
| logSw: | -6.8785 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.175 |
| InChI Key: | ABVVQSUDLXDOAW-UHFFFAOYSA-N |