2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenyl-N-(quinolin-6-yl)propanamide
Chemical Structure Depiction of
2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenyl-N-(quinolin-6-yl)propanamide
2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenyl-N-(quinolin-6-yl)propanamide
Compound characteristics
| Compound ID: | D027-0062 |
| Compound Name: | 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-3-phenyl-N-(quinolin-6-yl)propanamide |
| Molecular Weight: | 437.5 |
| Molecular Formula: | C27 H23 N3 O3 |
| Smiles: | C1C2C=CC1C1C2C(N(C(Cc2ccccc2)C(Nc2ccc3c(cccn3)c2)=O)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2095 |
| logD: | 3.2093 |
| logSw: | -3.1609 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.115 |
| InChI Key: | CDSKVFQQEZQMHN-UHFFFAOYSA-N |