N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide
Chemical Structure Depiction of
N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide
N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide
Compound characteristics
| Compound ID: | 7916-0407 |
| Compound Name: | N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-3-(3-nitrophenyl)prop-2-enamide |
| Molecular Weight: | 360.78 |
| Molecular Formula: | C15 H9 Cl N4 O3 S |
| Smiles: | C(=C/c1cccc(c1)[N+]([O-])=O)\C(Nc1c(ccc2c1nsn2)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2522 |
| logD: | 4.2362 |
| logSw: | -4.7277 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.055 |
| InChI Key: | IVCOTMYUAISXRK-UHFFFAOYSA-N |