N-[2-(4-chlorophenyl)ethyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-[2-(4-chlorophenyl)ethyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-1203 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 424.95 |
| Molecular Formula: | C23 H21 Cl N2 O2 S |
| Smiles: | CN1C(C(C(NCCc2ccc(cc2)[Cl])=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4552 |
| logD: | 3.4552 |
| logSw: | -4.0585 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.962 |
| InChI Key: | OVFUEFORWPOVRM-UHFFFAOYSA-N |