1-(benzenesulfonyl)-N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
1-(benzenesulfonyl)-N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
1-(benzenesulfonyl)-N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
Compound ID: | S733-3233 |
Compound Name: | 1-(benzenesulfonyl)-N-[3-(4-methylpiperidin-1-yl)propyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide |
Molecular Weight: | 492.68 |
Molecular Formula: | C25 H40 N4 O4 S |
Smiles: | CC1CCN(CCCNC(C2CCCN(CCC(NCC2)=O)S(c2ccccc2)(=O)=O)=O)CC1 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.0922 |
logD: | -1.4259 |
logSw: | -2.3422 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.541 |
InChI Key: | YWVVPNXNYBSTFQ-QFIPXVFZSA-N |