N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide
N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 7833-1737 |
| Compound Name: | N-(5-methyl-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 340.36 |
| Molecular Formula: | C16 H12 N4 O3 S |
| Smiles: | Cc1ccc2c(c1NC(/C=C/c1cccc(c1)[N+]([O-])=O)=O)nsn2 |
| Stereo: | ACHIRAL |
| logP: | 3.9116 |
| logD: | 3.9113 |
| logSw: | -3.9931 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.055 |
| InChI Key: | KWVWZNWZAZRORJ-UHFFFAOYSA-N |