4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[4-(morpholine-4-sulfonyl)phenyl]benzamide
Chemical Structure Depiction of
4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[4-(morpholine-4-sulfonyl)phenyl]benzamide
4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[4-(morpholine-4-sulfonyl)phenyl]benzamide
Compound characteristics
| Compound ID: | D672-0108 |
| Compound Name: | 4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]-N-[4-(morpholine-4-sulfonyl)phenyl]benzamide |
| Molecular Weight: | 491.61 |
| Molecular Formula: | C27 H29 N3 O4 S |
| Smiles: | C1CN(Cc2ccc(cc2)C(Nc2ccc(cc2)S(N2CCOCC2)(=O)=O)=O)Cc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.5505 |
| logD: | 3.2471 |
| logSw: | -3.7575 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.344 |
| InChI Key: | WGQPJPGVHXXIAT-UHFFFAOYSA-N |