2-[(4-methoxyphenyl)methyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[(4-methoxyphenyl)methyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
2-[(4-methoxyphenyl)methyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K603-0166 |
| Compound Name: | 2-[(4-methoxyphenyl)methyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione |
| Molecular Weight: | 283.32 |
| Molecular Formula: | C17 H17 N O3 |
| Smiles: | COc1ccc(CN2C(C3C4CC(C=C4)C3C2=O)=O)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0215 |
| logD: | 2.0215 |
| logSw: | -2.2673 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.88 |
| InChI Key: | MYKSRFWCOVNBSY-UHFFFAOYSA-N |