2-cyclopentyl-1-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-1-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclopentyl-1-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1125 |
| Compound Name: | 2-cyclopentyl-1-oxo-N-[3-(pyrrolidin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 451.63 |
| Molecular Formula: | C26 H33 N3 O2 S |
| Smiles: | C1CCC(C1)N1C(C(C(NCCCN2CCCC2)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.312 |
| logD: | 0.2215 |
| logSw: | -3.7389 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.86 |
| InChI Key: | XPBMPFYSONURIG-UHFFFAOYSA-N |