N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(2-chloro-6-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(2-chloro-6-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(2-chloro-6-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide
Compound characteristics
Compound ID: | D356-2269 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[(2-chloro-6-fluorophenyl)methanesulfonyl]piperidine-4-carboxamide |
Molecular Weight: | 468.93 |
Molecular Formula: | C21 H22 Cl F N2 O5 S |
Smiles: | C1CN(CCC1C(NCc1ccc2c(c1)OCO2)=O)S(Cc1c(cccc1[Cl])F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8522 |
logD: | 2.8522 |
logSw: | -3.4686 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.372 |
InChI Key: | DYRTVIRULFBEQT-UHFFFAOYSA-N |