2-cyclopentyl-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclopentyl-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1330 |
| Compound Name: | 2-cyclopentyl-N-{4-[(4-ethylpiperazin-1-yl)methyl]phenyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 542.74 |
| Molecular Formula: | C32 H38 N4 O2 S |
| Smiles: | CCN1CCN(CC1)Cc1ccc(cc1)NC(C1C(c2cccs2)N(C2CCCC2)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3062 |
| logD: | 3.3745 |
| logSw: | -4.0849 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.618 |
| InChI Key: | YUGIDUUOXHLBSO-UHFFFAOYSA-N |