2-(pyridin-3-yl)-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(pyridin-3-yl)-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}ethan-1-one
2-(pyridin-3-yl)-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S535-0274 |
| Compound Name: | 2-(pyridin-3-yl)-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}ethan-1-one |
| Molecular Weight: | 301.43 |
| Molecular Formula: | C18 H27 N3 O |
| Smiles: | C1CCN(C1)CC1CCCN(CC1)C(Cc1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4829 |
| logD: | -1.641 |
| logSw: | -0.7844 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.3068 |
| InChI Key: | ZRJVWWRPYVCPNP-MRXNPFEDSA-N |