N-{1-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-2-oxo-2-(pyrrolidin-1-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{1-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-2-oxo-2-(pyrrolidin-1-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide
N-{1-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-2-oxo-2-(pyrrolidin-1-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V003-4436 |
| Compound Name: | N-{1-[1-(4-chlorobenzene-1-sulfonyl)piperidin-4-yl]-2-oxo-2-(pyrrolidin-1-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 534.03 |
| Molecular Formula: | C25 H28 Cl N3 O6 S |
| Smiles: | C1CCN(C1)C(C(C1CCN(CC1)S(c1ccc(cc1)[Cl])(=O)=O)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7067 |
| logD: | 3.7067 |
| logSw: | -4.4126 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.845 |
| InChI Key: | MXMYGFJMIMISTD-QHCPKHFHSA-N |