N-[3-(azepan-1-yl)propyl]-4-(1,3-benzothiazol-2-yl)-N-(oxan-4-yl)butanamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-4-(1,3-benzothiazol-2-yl)-N-(oxan-4-yl)butanamide
N-[3-(azepan-1-yl)propyl]-4-(1,3-benzothiazol-2-yl)-N-(oxan-4-yl)butanamide
Compound characteristics
| Compound ID: | SC12-0312 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-4-(1,3-benzothiazol-2-yl)-N-(oxan-4-yl)butanamide |
| Molecular Weight: | 443.65 |
| Molecular Formula: | C25 H37 N3 O2 S |
| Smiles: | C1CCCN(CC1)CCCN(C1CCOCC1)C(CCCc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3399 |
| logD: | 1.9582 |
| logSw: | -4.2731 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.311 |
| InChI Key: | ZWTPOKQFXRDEBC-UHFFFAOYSA-N |