ethyl 4-{[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]amino}piperidine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]amino}piperidine-1-carboxylate
ethyl 4-{[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]amino}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E456-1193 |
| Compound Name: | ethyl 4-{[2-cyclopentyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carbonyl]amino}piperidine-1-carboxylate |
| Molecular Weight: | 495.64 |
| Molecular Formula: | C27 H33 N3 O4 S |
| Smiles: | CCOC(N1CCC(CC1)NC(C1C(c2cccs2)N(C2CCCC2)C(c2ccccc12)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8412 |
| logD: | 3.8412 |
| logSw: | -3.8791 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.176 |
| InChI Key: | YWVINPXBOCTJEX-UHFFFAOYSA-N |