N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide
Chemical Structure Depiction of
N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide
N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide
Compound characteristics
| Compound ID: | Y032-0583 |
| Compound Name: | N-(6-nitro-1,3-benzothiazol-2-yl)-3,3-diphenylpropanamide |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C22 H17 N3 O3 S |
| Smiles: | C(C(c1ccccc1)c1ccccc1)C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5033 |
| logD: | 5.502 |
| logSw: | -5.8062 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.988 |
| InChI Key: | BWJRKWONTNQMPK-UHFFFAOYSA-N |