(2S)-3-phenyl-1-[4-(piperidine-1-sulfonyl)-1,4-diazepan-1-yl]-2-(1H-pyrrol-1-yl)propan-1-one
Chemical Structure Depiction of
(2S)-3-phenyl-1-[4-(piperidine-1-sulfonyl)-1,4-diazepan-1-yl]-2-(1H-pyrrol-1-yl)propan-1-one
(2S)-3-phenyl-1-[4-(piperidine-1-sulfonyl)-1,4-diazepan-1-yl]-2-(1H-pyrrol-1-yl)propan-1-one
Compound characteristics
| Compound ID: | Y043-5757 |
| Compound Name: | (2S)-3-phenyl-1-[4-(piperidine-1-sulfonyl)-1,4-diazepan-1-yl]-2-(1H-pyrrol-1-yl)propan-1-one |
| Molecular Weight: | 444.6 |
| Molecular Formula: | C23 H32 N4 O3 S |
| Smiles: | C1CCN(CC1)S(N1CCCN(CC1)C([C@H](Cc1ccccc1)n1cccc1)=O)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8289 |
| logD: | 2.8289 |
| logSw: | -3.1982 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.665 |
| InChI Key: | DUMUSKBDAVFROW-QFIPXVFZSA-N |