2-cyclopentyl-1-oxo-N-[4-(propan-2-yl)phenyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-1-oxo-N-[4-(propan-2-yl)phenyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclopentyl-1-oxo-N-[4-(propan-2-yl)phenyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1110 |
| Compound Name: | 2-cyclopentyl-1-oxo-N-[4-(propan-2-yl)phenyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 458.62 |
| Molecular Formula: | C28 H30 N2 O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(C1C(c2cccs2)N(C2CCCC2)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0444 |
| logD: | 6.0443 |
| logSw: | -5.4519 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.348 |
| InChI Key: | VXEWVLICXWMRBF-UHFFFAOYSA-N |