N~1~,N~1~,N~3~,N~3~-tetrakis(cyanomethyl)-5-nitrobenzene-1,3-dicarboxamide
Chemical Structure Depiction of
N~1~,N~1~,N~3~,N~3~-tetrakis(cyanomethyl)-5-nitrobenzene-1,3-dicarboxamide
N~1~,N~1~,N~3~,N~3~-tetrakis(cyanomethyl)-5-nitrobenzene-1,3-dicarboxamide
Compound characteristics
| Compound ID: | Y032-0120 |
| Compound Name: | N~1~,N~1~,N~3~,N~3~-tetrakis(cyanomethyl)-5-nitrobenzene-1,3-dicarboxamide |
| Molecular Weight: | 365.31 |
| Molecular Formula: | C16 H11 N7 O4 |
| Smiles: | C(C#N)N(CC#N)C(c1cc(cc(c1)[N+]([O-])=O)C(N(CC#N)CC#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.1212 |
| logD: | -1.1212 |
| logSw: | -0.9784 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 136.466 |
| InChI Key: | FKOMNAVYABLFOX-UHFFFAOYSA-N |