N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]benzamide
Chemical Structure Depiction of
N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]benzamide
N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]benzamide
Compound characteristics
| Compound ID: | Y205-3994 |
| Compound Name: | N-[4-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)phenyl]benzamide |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C22 H20 N2 O3 S |
| Smiles: | C1CN(Cc2ccccc12)S(c1ccc(cc1)NC(c1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0521 |
| logD: | 4.0339 |
| logSw: | -4.1334 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.702 |
| InChI Key: | BBNLAEYFZVWPQM-UHFFFAOYSA-N |