5-[4-(2-chlorophenyl)piperazin-1-yl]-2-(4-methylphenyl)-6-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
5-[4-(2-chlorophenyl)piperazin-1-yl]-2-(4-methylphenyl)-6-nitro-1H-isoindole-1,3(2H)-dione
5-[4-(2-chlorophenyl)piperazin-1-yl]-2-(4-methylphenyl)-6-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K906-0364 |
| Compound Name: | 5-[4-(2-chlorophenyl)piperazin-1-yl]-2-(4-methylphenyl)-6-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 476.92 |
| Molecular Formula: | C25 H21 Cl N4 O4 |
| Smiles: | Cc1ccc(cc1)N1C(c2cc(c(cc2C1=O)N1CCN(CC1)c1ccccc1[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3738 |
| logD: | 5.3738 |
| logSw: | -5.8239 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.071 |
| InChI Key: | XFYCTCDIXXVZOO-UHFFFAOYSA-N |