5,5-dioxo-N-(2-phenylethyl)-5,6-dihydro-4H-5lambda~6~-thieno[3,4-b]thiophene-2-carboxamide
Chemical Structure Depiction of
5,5-dioxo-N-(2-phenylethyl)-5,6-dihydro-4H-5lambda~6~-thieno[3,4-b]thiophene-2-carboxamide
5,5-dioxo-N-(2-phenylethyl)-5,6-dihydro-4H-5lambda~6~-thieno[3,4-b]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | C771-0086 |
| Compound Name: | 5,5-dioxo-N-(2-phenylethyl)-5,6-dihydro-4H-5lambda~6~-thieno[3,4-b]thiophene-2-carboxamide |
| Molecular Weight: | 321.41 |
| Molecular Formula: | C15 H15 N O3 S2 |
| Smiles: | C(CNC(c1cc2CS(Cc2s1)(=O)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8404 |
| logD: | 1.8404 |
| logSw: | -2.4256 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.869 |
| InChI Key: | RAFRJOKGUOMAKM-UHFFFAOYSA-N |