(3,4-dihydroisoquinolin-2(1H)-yl)[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrol-2-yl]methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrol-2-yl]methanone
(3,4-dihydroisoquinolin-2(1H)-yl)[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrol-2-yl]methanone
Compound characteristics
| Compound ID: | F638-3073 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)[1,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrrol-2-yl]methanone |
| Molecular Weight: | 415.55 |
| Molecular Formula: | C22 H29 N3 O3 S |
| Smiles: | CC1CCN(CC1)S(c1cc(C(N2CCc3ccccc3C2)=O)n(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0893 |
| logD: | 3.0893 |
| logSw: | -3.4322 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.292 |
| InChI Key: | DXGRTSCAAXCJFU-UHFFFAOYSA-N |