3-{N-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]hexanamido}benzoic acid
Chemical Structure Depiction of
3-{N-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]hexanamido}benzoic acid
3-{N-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]hexanamido}benzoic acid
Compound characteristics
| Compound ID: | 8008-3787 |
| Compound Name: | 3-{N-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]hexanamido}benzoic acid |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C22 H22 N2 O5 |
| Smiles: | CCCCCC(N(CN1C(c2ccccc2C1=O)=O)c1cccc(c1)C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6124 |
| logD: | 1.9272 |
| logSw: | -4.3318 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.688 |
| InChI Key: | PHVLDTUDZOUCPR-UHFFFAOYSA-N |