N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methoxybenzamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methoxybenzamide
N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methoxybenzamide
Compound characteristics
| Compound ID: | F866-0267 |
| Compound Name: | N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-3-methoxybenzamide |
| Molecular Weight: | 374.46 |
| Molecular Formula: | C19 H22 N2 O4 S |
| Smiles: | COc1cccc(c1)C(NCCS(N1CCc2ccccc2C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0941 |
| logD: | 2.0941 |
| logSw: | -2.9588 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.576 |
| InChI Key: | KWUYYBKIULEVQS-UHFFFAOYSA-N |