N-(2-chloro-4-methylphenyl)-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-chloro-4-methylphenyl)-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(2-chloro-4-methylphenyl)-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0175 |
| Compound Name: | N-(2-chloro-4-methylphenyl)-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 410.92 |
| Molecular Formula: | C22 H19 Cl N2 O2 S |
| Smiles: | Cc1ccc(c(c1)[Cl])NC(C1C(c2cccs2)N(C)C(c2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2818 |
| logD: | 4.2748 |
| logSw: | -4.4696 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.1 |
| InChI Key: | SWLBGHXMMBBGNN-UHFFFAOYSA-N |