2-(3,5-dimethylanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
Chemical Structure Depiction of
2-(3,5-dimethylanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
2-(3,5-dimethylanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 6704-0036 |
| Compound Name: | 2-(3,5-dimethylanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C23 H25 N3 O2 |
| Smiles: | Cc1cc(C)cc(c1)NC1=C(C(c2ccccc2C1=O)=O)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.6121 |
| logD: | 3.404 |
| logSw: | -4.0065 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.411 |
| InChI Key: | UMHUVDIXLQSVDB-UHFFFAOYSA-N |