N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0673 |
| Compound Name: | N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1-[(pyridin-4-yl)methyl]-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 443.63 |
| Molecular Formula: | C25 H41 N5 O2 |
| Smiles: | CC1CCN(CCCNC(C2CCCN(CCC(NCC2)=O)Cc2ccncc2)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2222 |
| logD: | -2.296 |
| logSw: | -1.2579 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.991 |
| InChI Key: | FIXNUUFFMKHVCJ-QHCPKHFHSA-N |