4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(3-phenylpropyl)butanamide
Chemical Structure Depiction of
4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(3-phenylpropyl)butanamide
4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(3-phenylpropyl)butanamide
Compound characteristics
| Compound ID: | Y043-0413 |
| Compound Name: | 4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(3-phenylpropyl)butanamide |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | C(Cc1ccccc1)CNC(CCCN1C(c2ccccc2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.707 |
| logD: | 2.707 |
| logSw: | -3.4796 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.918 |
| InChI Key: | IBXDIZNAGFBJKO-UHFFFAOYSA-N |