N-{4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phenyl}-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-{4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phenyl}-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide
N-{4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phenyl}-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V006-0264 |
| Compound Name: | N-{4-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]phenyl}-N-[(3-methylphenyl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 480.63 |
| Molecular Formula: | C30 H28 N2 O2 S |
| Smiles: | Cc1cccc(CN(C(c2cccs2)=O)c2ccc(CC(N3CCc4ccccc4C3)=O)cc2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.4978 |
| logD: | 6.4978 |
| logSw: | -5.6148 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.391 |
| InChI Key: | NEBLFPMKZLNNHT-UHFFFAOYSA-N |