N-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]-N'-(pyridin-2-yl)urea
Chemical Structure Depiction of
N-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]-N'-(pyridin-2-yl)urea
N-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]-N'-(pyridin-2-yl)urea
Compound characteristics
| Compound ID: | 5988-0058 |
| Compound Name: | N-[4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]-N'-(pyridin-2-yl)urea |
| Molecular Weight: | 374.4 |
| Molecular Formula: | C21 H18 N4 O3 |
| Smiles: | C1C2C=CC1C1C2C(N(C1=O)c1ccc(cc1)NC(Nc1ccccn1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.3258 |
| logD: | 2.3247 |
| logSw: | -2.874 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.643 |
| InChI Key: | HJWZGNYOFXWRSQ-UHFFFAOYSA-N |