4-[4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)anilino]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)anilino]-4-oxobutanoic acid
4-[4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)anilino]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 3043-0105 |
| Compound Name: | 4-[4-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)anilino]-4-oxobutanoic acid |
| Molecular Weight: | 356.38 |
| Molecular Formula: | C19 H20 N2 O5 |
| Smiles: | C1CC2CC1C1C2C(N(C1=O)c1ccc(cc1)NC(CCC(O)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.2399 |
| logD: | -2.7095 |
| logSw: | -1.7768 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.258 |
| InChI Key: | VKGITFIUIGCQGE-UHFFFAOYSA-N |