5-benzoyl-9-{4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-benzoyl-9-{4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one
5-benzoyl-9-{4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-2237 |
| Compound Name: | 5-benzoyl-9-{4-[(2-fluorophenyl)methyl]piperazine-1-carbonyl}-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C28 H35 F N4 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)C(c1ccccc1)=O)=O)C(N1CCN(CC1)Cc1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4019 |
| logD: | 1.3804 |
| logSw: | -2.1169 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.43 |
| InChI Key: | QSCJIVHEDACAFD-QHCPKHFHSA-N |