2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enenitrile
2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 1246-0741 |
| Compound Name: | 2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enenitrile |
| Molecular Weight: | 421.73 |
| Molecular Formula: | C19 H11 Cl3 N2 O S |
| Smiles: | COc1c(\C=C(/C#N)c2nc(cs2)c2ccc(cc2)[Cl])cc(cc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.1956 |
| logD: | 7.1956 |
| logSw: | -6.7958 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.474 |
| InChI Key: | DPXVDFMMJIIGSX-UHFFFAOYSA-N |