7-chloro-5,5-dioxo-N-[2-(thiophen-3-yl)ethyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
7-chloro-5,5-dioxo-N-[2-(thiophen-3-yl)ethyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
7-chloro-5,5-dioxo-N-[2-(thiophen-3-yl)ethyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C918-0215 |
| Compound Name: | 7-chloro-5,5-dioxo-N-[2-(thiophen-3-yl)ethyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 423.96 |
| Molecular Formula: | C18 H14 Cl N O3 S3 |
| Smiles: | C(CNC(c1cc2CS(c3cc(ccc3c2s1)[Cl])(=O)=O)=O)c1ccsc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7064 |
| logD: | 3.7064 |
| logSw: | -4.2962 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.705 |
| InChI Key: | XNRZFABNKHBKJS-UHFFFAOYSA-N |