N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-N'-(pyridin-3-yl)urea
Chemical Structure Depiction of
N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-N'-(pyridin-3-yl)urea
N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-N'-(pyridin-3-yl)urea
Compound characteristics
| Compound ID: | 5928-0022 |
| Compound Name: | N-[(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)methyl]-N'-(pyridin-3-yl)urea |
| Molecular Weight: | 312.33 |
| Molecular Formula: | C16 H16 N4 O3 |
| Smiles: | C1C2C=CC1C1C2C(N(CNC(Nc2cccnc2)=O)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.4401 |
| logD: | 0.4394 |
| logSw: | -1.1451 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.404 |
| InChI Key: | QUFBVLNPMPYRPT-UHFFFAOYSA-N |