2-(2,4-dimethylanilino)-3-(4-phenylpiperazin-1-yl)naphthalene-1,4-dione
Chemical Structure Depiction of
2-(2,4-dimethylanilino)-3-(4-phenylpiperazin-1-yl)naphthalene-1,4-dione
2-(2,4-dimethylanilino)-3-(4-phenylpiperazin-1-yl)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 7217-0029 |
| Compound Name: | 2-(2,4-dimethylanilino)-3-(4-phenylpiperazin-1-yl)naphthalene-1,4-dione |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C28 H27 N3 O2 |
| Smiles: | Cc1ccc(c(C)c1)NC1=C(C(c2ccccc2C1=O)=O)N1CCN(CC1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5423 |
| logD: | 4.7682 |
| logSw: | -5.4407 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.496 |
| InChI Key: | GKTNKFOTKDOMMW-UHFFFAOYSA-N |