2-(2-methylpropyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methylpropyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-(2-methylpropyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0723 |
| Compound Name: | 2-(2-methylpropyl)-N-[3-(morpholin-4-yl)propyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C25 H33 N3 O3 S |
| Smiles: | CC(C)CN1C(C(C(NCCCN2CCOCC2)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6818 |
| logD: | 2.2583 |
| logSw: | -3.2507 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.087 |
| InChI Key: | UBUBZWKRJXFDIX-UHFFFAOYSA-N |