2-(3-bromoanilino)-3-(piperidin-1-yl)naphthalene-1,4-dione
Chemical Structure Depiction of
2-(3-bromoanilino)-3-(piperidin-1-yl)naphthalene-1,4-dione
2-(3-bromoanilino)-3-(piperidin-1-yl)naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 8005-0109 |
| Compound Name: | 2-(3-bromoanilino)-3-(piperidin-1-yl)naphthalene-1,4-dione |
| Molecular Weight: | 411.3 |
| Molecular Formula: | C21 H19 Br N2 O2 |
| Smiles: | C1CCN(CC1)C1=C(C(c2ccccc2C1=O)=O)Nc1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.9091 |
| logD: | 4.2906 |
| logSw: | -4.7157 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.934 |
| InChI Key: | NGSWPHJNQRQXNI-UHFFFAOYSA-N |