N-(2,6-dimethylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
N-(2,6-dimethylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C797-0019 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-[(2-nitrothiophen-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 322.4 |
| Molecular Formula: | C14 H14 N2 O3 S2 |
| Smiles: | Cc1cccc(C)c1NC(CSc1ccsc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0226 |
| logD: | 3.0226 |
| logSw: | -3.088 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.171 |
| InChI Key: | XTUUBDKVDUNQEX-UHFFFAOYSA-N |