N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea
Chemical Structure Depiction of
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea
N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea
Compound characteristics
| Compound ID: | C270-0240 |
| Compound Name: | N-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethyl}-N'-(4-nitrophenyl)urea |
| Molecular Weight: | 397.48 |
| Molecular Formula: | C21 H27 N5 O3 |
| Smiles: | Cc1cccc(c1C)N1CCN(CCNC(Nc2ccc(cc2)[N+]([O-])=O)=O)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.982 |
| logD: | 2.425 |
| logSw: | -4.0362 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.029 |
| InChI Key: | IIDHNLKNMYLXNN-UHFFFAOYSA-N |