N-{4-[4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)-2-nitroanilino]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)-2-nitroanilino]phenyl}acetamide
N-{4-[4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)-2-nitroanilino]phenyl}acetamide
Compound characteristics
| Compound ID: | K807-0668 |
| Compound Name: | N-{4-[4-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)-2-nitroanilino]phenyl}acetamide |
| Molecular Weight: | 436.47 |
| Molecular Formula: | C23 H24 N4 O5 |
| Smiles: | CC1CCC2C(C1)C(N(C2=O)c1ccc(c(c1)[N+]([O-])=O)Nc1ccc(cc1)NC(C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.7312 |
| logD: | 3.7312 |
| logSw: | -4.0979 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.629 |
| InChI Key: | QRPAGYFGSCUBFK-UHFFFAOYSA-N |