4-{1-[3-(1,3-benzothiazol-2-yl)propanoyl]pyrrolidin-3-yl}-N-methylpiperidine-1-carboxamide
Chemical Structure Depiction of
4-{1-[3-(1,3-benzothiazol-2-yl)propanoyl]pyrrolidin-3-yl}-N-methylpiperidine-1-carboxamide
4-{1-[3-(1,3-benzothiazol-2-yl)propanoyl]pyrrolidin-3-yl}-N-methylpiperidine-1-carboxamide
Compound characteristics
Compound ID: | S632-6867 |
Compound Name: | 4-{1-[3-(1,3-benzothiazol-2-yl)propanoyl]pyrrolidin-3-yl}-N-methylpiperidine-1-carboxamide |
Molecular Weight: | 400.54 |
Molecular Formula: | C21 H28 N4 O2 S |
Smiles: | CNC(N1CCC(CC1)C1CCN(C1)C(CCc1nc2ccccc2s1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.72 |
logD: | 2.72 |
logSw: | -3.0073 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.816 |
InChI Key: | BXTZYBCXROLXQM-MRXNPFEDSA-N |