2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(3-nitrophenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(3-nitrophenyl)prop-2-enenitrile
2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(3-nitrophenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | 1246-0717 |
| Compound Name: | 2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(3-nitrophenyl)prop-2-enenitrile |
| Molecular Weight: | 347.39 |
| Molecular Formula: | C19 H13 N3 O2 S |
| Smiles: | Cc1ccc(cc1)c1csc(C(=C\c2cccc(c2)[N+]([O-])=O)\C#N)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.669 |
| logD: | 5.669 |
| logSw: | -5.6285 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.139 |
| InChI Key: | PKJHLAVCIQMFEW-UHFFFAOYSA-N |