(5S)-N-[2-(4-benzylpiperidin-1-yl)ethyl]-5-methoxy-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Chemical Structure Depiction of
(5S)-N-[2-(4-benzylpiperidin-1-yl)ethyl]-5-methoxy-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
(5S)-N-[2-(4-benzylpiperidin-1-yl)ethyl]-5-methoxy-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide
Compound characteristics
Compound ID: | SB69-0047 |
Compound Name: | (5S)-N-[2-(4-benzylpiperidin-1-yl)ethyl]-5-methoxy-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-2-carboxamide |
Molecular Weight: | 382.5 |
Molecular Formula: | C22 H30 N4 O2 |
Smiles: | CO[C@H]1Cc2cc(C(NCCN3CCC(CC3)Cc3ccccc3)=O)nn2C1 |
Stereo: | ABSOLUTE |
logP: | 2.3997 |
logD: | 1.5982 |
logSw: | -2.8711 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.291 |
InChI Key: | MCOKAUIZHMQYHL-HXUWFJFHSA-N |