N-(3-cyano-4,5-dimethylthiophen-2-yl)-2,4-dinitrobenzamide
Chemical Structure Depiction of
N-(3-cyano-4,5-dimethylthiophen-2-yl)-2,4-dinitrobenzamide
N-(3-cyano-4,5-dimethylthiophen-2-yl)-2,4-dinitrobenzamide
Compound characteristics
| Compound ID: | 8005-2545 |
| Compound Name: | N-(3-cyano-4,5-dimethylthiophen-2-yl)-2,4-dinitrobenzamide |
| Molecular Weight: | 346.32 |
| Molecular Formula: | C14 H10 N4 O5 S |
| Smiles: | Cc1c(C#N)c(NC(c2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 3.0129 |
| logD: | -2.2541 |
| logSw: | -3.6325 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.642 |
| InChI Key: | HXEAXLLWMGATOL-UHFFFAOYSA-N |