1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}-2-(thiophen-3-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}-2-(thiophen-3-yl)ethan-1-one
1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}-2-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | S535-0262 |
| Compound Name: | 1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 306.47 |
| Molecular Formula: | C17 H26 N2 O S |
| Smiles: | C1CCN(C1)CC1CCCN(CC1)C(Cc1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5218 |
| logD: | -0.6021 |
| logSw: | -2.4611 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.8073 |
| InChI Key: | KQZANAMIENDBSY-OAHLLOKOSA-N |