4-(4-benzylpiperazin-1-yl)-5-nitrobenzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-(4-benzylpiperazin-1-yl)-5-nitrobenzene-1,2-dicarbonitrile
4-(4-benzylpiperazin-1-yl)-5-nitrobenzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 3257-3052 |
| Compound Name: | 4-(4-benzylpiperazin-1-yl)-5-nitrobenzene-1,2-dicarbonitrile |
| Molecular Weight: | 347.37 |
| Molecular Formula: | C19 H17 N5 O2 |
| Smiles: | C1CN(CCN1Cc1ccccc1)c1cc(C#N)c(C#N)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7783 |
| logD: | 2.7014 |
| logSw: | -3.5554 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.123 |
| InChI Key: | DDJGAEXFQXVESH-UHFFFAOYSA-N |