N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylbutanamide
Chemical Structure Depiction of
N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylbutanamide
N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylbutanamide
Compound characteristics
| Compound ID: | Y032-2263 |
| Compound Name: | N-(6-nitro-1,3-benzothiazol-2-yl)-3-phenylbutanamide |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | CC(CC(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8004 |
| logD: | 4.7999 |
| logSw: | -4.5732 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.259 |
| InChI Key: | XCJRXPUYESSRBG-NSHDSACASA-N |