2-[4-(2-bromobenzoyl)piperazin-1-yl]-3-chloronaphthalene-1,4-dione
Chemical Structure Depiction of
2-[4-(2-bromobenzoyl)piperazin-1-yl]-3-chloronaphthalene-1,4-dione
2-[4-(2-bromobenzoyl)piperazin-1-yl]-3-chloronaphthalene-1,4-dione
Compound characteristics
| Compound ID: | 5395-2127 |
| Compound Name: | 2-[4-(2-bromobenzoyl)piperazin-1-yl]-3-chloronaphthalene-1,4-dione |
| Molecular Weight: | 459.73 |
| Molecular Formula: | C21 H16 Br Cl N2 O3 |
| Smiles: | C1CN(CCN1C1=C(C(c2ccccc2C1=O)=O)[Cl])C(c1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8916 |
| logD: | 3.8916 |
| logSw: | -4.4175 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.279 |
| InChI Key: | ULDAKXVLBCNQND-UHFFFAOYSA-N |