5-(adamantan-1-yl)-2-(2,5-dimethoxyphenyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-(adamantan-1-yl)-2-(2,5-dimethoxyphenyl)-1H-isoindole-1,3(2H)-dione
5-(adamantan-1-yl)-2-(2,5-dimethoxyphenyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 7406-0040 |
Compound Name: | 5-(adamantan-1-yl)-2-(2,5-dimethoxyphenyl)-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 417.5 |
Molecular Formula: | C26 H27 N O4 |
Smiles: | COc1ccc(c(c1)N1C(c2ccc(cc2C1=O)C12CC3CC(CC(C3)C2)C1)=O)OC |
Stereo: | ACHIRAL |
logP: | 6.3177 |
logD: | 6.3177 |
logSw: | -5.5645 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 43.515 |
InChI Key: | AQTOLNBAUQORLD-UHFFFAOYSA-N |