N-(6-nitro-1,3-benzothiazol-2-yl)-4-phenylbutanamide
Chemical Structure Depiction of
N-(6-nitro-1,3-benzothiazol-2-yl)-4-phenylbutanamide
N-(6-nitro-1,3-benzothiazol-2-yl)-4-phenylbutanamide
Compound characteristics
| Compound ID: | Y032-2416 |
| Compound Name: | N-(6-nitro-1,3-benzothiazol-2-yl)-4-phenylbutanamide |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | C(CC(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5278 |
| logD: | 4.5267 |
| logSw: | -4.4886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.259 |
| InChI Key: | AGROGKWLGKFRBN-UHFFFAOYSA-N |