4-phenyl-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}butan-1-one
Chemical Structure Depiction of
4-phenyl-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}butan-1-one
4-phenyl-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S535-0263 |
| Compound Name: | 4-phenyl-1-{4-[(pyrrolidin-1-yl)methyl]azepan-1-yl}butan-1-one |
| Molecular Weight: | 328.5 |
| Molecular Formula: | C21 H32 N2 O |
| Smiles: | C(CC(N1CCCC(CC1)CN1CCCC1)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6601 |
| logD: | 0.5362 |
| logSw: | -3.9424 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.7889 |
| InChI Key: | MUYPPJVWHUFJNU-HXUWFJFHSA-N |