9-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-5-[(pyridin-4-yl)methyl]-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
9-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-5-[(pyridin-4-yl)methyl]-1,5-diazacycloundecan-2-one
9-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-5-[(pyridin-4-yl)methyl]-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-0302 |
| Compound Name: | 9-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-5-[(pyridin-4-yl)methyl]-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 479.62 |
| Molecular Formula: | C27 H37 N5 O3 |
| Smiles: | COc1cccc(c1)N1CCN(CC1)C(C1CCCN(CCC(NCC1)=O)Cc1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9455 |
| logD: | 0.8773 |
| logSw: | -1.6571 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.206 |
| InChI Key: | LKSAFWMCEMPAFC-QHCPKHFHSA-N |