N-(3-cyano-4,5-dimethylthiophen-2-yl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(3-cyano-4,5-dimethylthiophen-2-yl)-4-nitrobenzamide
N-(3-cyano-4,5-dimethylthiophen-2-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8005-8473 |
| Compound Name: | N-(3-cyano-4,5-dimethylthiophen-2-yl)-4-nitrobenzamide |
| Molecular Weight: | 301.32 |
| Molecular Formula: | C14 H11 N3 O3 S |
| Smiles: | Cc1c(C#N)c(NC(c2ccc(cc2)[N+]([O-])=O)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 3.1452 |
| logD: | 0.3272 |
| logSw: | -3.5591 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.562 |
| InChI Key: | WQMSXPYGCANMTN-UHFFFAOYSA-N |