(3,4-dihydroisoquinolin-2(1H)-yl){4-[(4-methylpiperazine-1-sulfonyl)methyl]phenyl}methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl){4-[(4-methylpiperazine-1-sulfonyl)methyl]phenyl}methanone
(3,4-dihydroisoquinolin-2(1H)-yl){4-[(4-methylpiperazine-1-sulfonyl)methyl]phenyl}methanone
Compound characteristics
| Compound ID: | Y300-0520 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl){4-[(4-methylpiperazine-1-sulfonyl)methyl]phenyl}methanone |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C22 H27 N3 O3 S |
| Smiles: | CN1CCN(CC1)S(Cc1ccc(cc1)C(N1CCc2ccccc2C1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5722 |
| logD: | 1.5227 |
| logSw: | -2.3055 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.63 |
| InChI Key: | ZHWHGJPCGYLCAB-UHFFFAOYSA-N |