{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(2-chloro-4,5-difluorophenyl)methanone
Chemical Structure Depiction of
{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(2-chloro-4,5-difluorophenyl)methanone
{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(2-chloro-4,5-difluorophenyl)methanone
Compound characteristics
| Compound ID: | 3610-1268 |
| Compound Name: | {4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(2-chloro-4,5-difluorophenyl)methanone |
| Molecular Weight: | 486.9 |
| Molecular Formula: | C24 H21 Cl F2 N4 O3 |
| Smiles: | C(c1ccccc1)Nc1cc(ccc1[N+]([O-])=O)N1CCN(CC1)C(c1cc(c(cc1[Cl])F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8701 |
| logD: | 4.8701 |
| logSw: | -5.1649 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.764 |
| InChI Key: | YMQWLNWDWMKZQQ-UHFFFAOYSA-N |