2-{[4-(adamantan-1-yl)anilino]methyl}-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{[4-(adamantan-1-yl)anilino]methyl}-1H-isoindole-1,3(2H)-dione
2-{[4-(adamantan-1-yl)anilino]methyl}-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 1497-1212 |
| Compound Name: | 2-{[4-(adamantan-1-yl)anilino]methyl}-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 386.49 |
| Molecular Formula: | C25 H26 N2 O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1ccc(cc1)NCN1C(c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.967 |
| logD: | 5.967 |
| logSw: | -6.0147 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.413 |
| InChI Key: | OLKIRXUQSYOXAK-UHFFFAOYSA-N |