methyl 4-{5-[(4-bromophenyl)carbamoyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoate
Chemical Structure Depiction of
methyl 4-{5-[(4-bromophenyl)carbamoyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoate
methyl 4-{5-[(4-bromophenyl)carbamoyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoate
Compound characteristics
| Compound ID: | 1606-0652 |
| Compound Name: | methyl 4-{5-[(4-bromophenyl)carbamoyl]-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl}benzoate |
| Molecular Weight: | 479.29 |
| Molecular Formula: | C23 H15 Br N2 O5 |
| Smiles: | COC(c1ccc(cc1)N1C(c2ccc(cc2C1=O)C(Nc1ccc(cc1)[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7417 |
| logD: | 4.6965 |
| logSw: | -4.6183 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.145 |
| InChI Key: | PIYOOQHFGNUTKW-UHFFFAOYSA-N |