N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-4-phenylbutanamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-4-phenylbutanamide
N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-4-phenylbutanamide
Compound characteristics
| Compound ID: | F866-0066 |
| Compound Name: | N-[2-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)ethyl]-4-phenylbutanamide |
| Molecular Weight: | 386.51 |
| Molecular Formula: | C21 H26 N2 O3 S |
| Smiles: | C(CC(NCCS(N1CCc2ccccc2C1)(=O)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.7519 |
| logD: | 2.7519 |
| logSw: | -3.2701 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.819 |
| InChI Key: | IGWASUFNMBDGJA-UHFFFAOYSA-N |