N-(4-bromophenyl)-2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
N-(4-bromophenyl)-2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
Compound ID: | 1606-0650 |
Compound Name: | N-(4-bromophenyl)-2-(3-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxamide |
Molecular Weight: | 466.25 |
Molecular Formula: | C21 H12 Br N3 O5 |
Smiles: | c1cc(cc(c1)N1C(c2ccc(cc2C1=O)C(Nc1ccc(cc1)[Br])=O)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.5262 |
logD: | 4.481 |
logSw: | -4.5179 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 85.353 |
InChI Key: | IWIAIHLRANDYGP-UHFFFAOYSA-N |