N-(1-benzylpiperidin-4-yl)-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(1-benzylpiperidin-4-yl)-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1199 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 513.7 |
| Molecular Formula: | C31 H35 N3 O2 S |
| Smiles: | C1CCC(C1)N1C(C(C(NC2CCN(CC2)Cc2ccccc2)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6917 |
| logD: | 3.134 |
| logSw: | -4.5608 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.936 |
| InChI Key: | DREGXDDIMRKLTI-UHFFFAOYSA-N |