N-[(4-chlorophenyl)methyl]-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-[(4-chlorophenyl)methyl]-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1249 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 465.01 |
| Molecular Formula: | C26 H25 Cl N2 O2 S |
| Smiles: | C1CCC(C1)N1C(C(C(NCc2ccc(cc2)[Cl])=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7285 |
| logD: | 4.7285 |
| logSw: | -5.0776 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.67 |
| InChI Key: | GMCGJODQAFZTKJ-UHFFFAOYSA-N |