2-cyclopentyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclopentyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1202 |
| Compound Name: | 2-cyclopentyl-N-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 560.73 |
| Molecular Formula: | C32 H37 F N4 O2 S |
| Smiles: | C1CCC(C1)N1C(C(C(NCCCN2CCN(CC2)c2ccc(cc2)F)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4505 |
| logD: | 3.8643 |
| logSw: | -4.2314 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.755 |
| InChI Key: | COUHLFJHQDMRMA-UHFFFAOYSA-N |