3-(2-chlorophenyl)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Chemical Structure Depiction of
3-(2-chlorophenyl)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
3-(2-chlorophenyl)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Compound characteristics
Compound ID: | 1246-0560 |
Compound Name: | 3-(2-chlorophenyl)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile |
Molecular Weight: | 367.81 |
Molecular Formula: | C18 H10 Cl N3 O2 S |
Smiles: | C(=C(/C#N)c1nc(cs1)c1ccc(cc1)[N+]([O-])=O)/c1ccccc1[Cl] |
Stereo: | ACHIRAL |
logP: | 5.7798 |
logD: | 5.7798 |
logSw: | -6.202 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 60.139 |
InChI Key: | KVGMBRNEIQSPNF-UHFFFAOYSA-N |