(3,4-dihydroisoquinolin-2(1H)-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
(3,4-dihydroisoquinolin-2(1H)-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone
Compound characteristics
| Compound ID: | G637-1360 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)(1-{3-methyl-5-[2-(2,4,6-trimethylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidin-4-yl)methanone |
| Molecular Weight: | 533.69 |
| Molecular Formula: | C30 H35 N3 O4 S |
| Smiles: | Cc1cc(C)c(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(N2CCc3ccccc3C2)=O)(=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2697 |
| logD: | 5.2697 |
| logSw: | -5.0978 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.775 |
| InChI Key: | AHXAAUHJMNPASM-UHFFFAOYSA-N |