9-(4-benzylpiperazine-1-carbonyl)-5-[(pyridin-3-yl)methyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-(4-benzylpiperazine-1-carbonyl)-5-[(pyridin-3-yl)methyl]-1,5-diazacycloundecan-2-one
9-(4-benzylpiperazine-1-carbonyl)-5-[(pyridin-3-yl)methyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-0499 |
| Compound Name: | 9-(4-benzylpiperazine-1-carbonyl)-5-[(pyridin-3-yl)methyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 463.62 |
| Molecular Formula: | C27 H37 N5 O2 |
| Smiles: | C1CC(CCNC(CCN(C1)Cc1cccnc1)=O)C(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5619 |
| logD: | 0.4044 |
| logSw: | -1.1641 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.032 |
| InChI Key: | HVLWXKRAXUKBTA-VWLOTQADSA-N |