N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0431 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 485 |
| Molecular Formula: | C25 H25 Cl N2 O4 S |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(C1C(c2cccs2)N(CCOC)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7483 |
| logD: | 4.675 |
| logSw: | -4.87 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.286 |
| InChI Key: | ITXCFERPLSRQLN-UHFFFAOYSA-N |