5-bromo-2-[(2-methylanilino)methyl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-bromo-2-[(2-methylanilino)methyl]-1H-isoindole-1,3(2H)-dione
5-bromo-2-[(2-methylanilino)methyl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 0627-0042 |
| Compound Name: | 5-bromo-2-[(2-methylanilino)methyl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 345.19 |
| Molecular Formula: | C16 H13 Br N2 O2 |
| Smiles: | Cc1ccccc1NCN1C(c2ccc(cc2C1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7676 |
| logD: | 3.7676 |
| logSw: | -3.8626 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.953 |
| InChI Key: | MFVZWQGVTIONPY-UHFFFAOYSA-N |