2-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
Chemical Structure Depiction of
2-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
2-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 7217-0044 |
| Compound Name: | 2-(3-methoxyanilino)-3-(4-methylpiperazin-1-yl)naphthalene-1,4-dione |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C22 H23 N3 O3 |
| Smiles: | CN1CCN(CC1)C1=C(C(c2ccccc2C1=O)=O)Nc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9855 |
| logD: | 2.6538 |
| logSw: | -3.8152 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.954 |
| InChI Key: | BRYNBEMCVAOKCU-UHFFFAOYSA-N |