2-{[4-methoxy-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{[4-methoxy-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
2-{[4-methoxy-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | F383-0897 |
Compound Name: | 2-{[4-methoxy-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)phenyl]methyl}hexahydro-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 494.61 |
Molecular Formula: | C27 H30 N2 O5 S |
Smiles: | COc1ccc(CN2C(C3CCCCC3C2=O)=O)cc1S(N1CCC(=CC1)c1ccccc1)(=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.1093 |
logD: | 4.1093 |
logSw: | -4.2755 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 68.753 |
InChI Key: | WVRMDGWNLTVHSV-UHFFFAOYSA-N |