2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide
Chemical Structure Depiction of
2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide
2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | Y032-3001 |
| Compound Name: | 2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylprop-2-enamide |
| Molecular Weight: | 339.37 |
| Molecular Formula: | C17 H13 N3 O3 S |
| Smiles: | C/C(=C\c1ccccc1)C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.737 |
| logD: | 4.7369 |
| logSw: | -4.6218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.473 |
| InChI Key: | NCAVOTMEMZFWEF-UHFFFAOYSA-N |