7-chloro-2-(4-ethylpiperazine-1-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione
Chemical Structure Depiction of
7-chloro-2-(4-ethylpiperazine-1-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione
7-chloro-2-(4-ethylpiperazine-1-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione
Compound characteristics
| Compound ID: | C918-0067 |
| Compound Name: | 7-chloro-2-(4-ethylpiperazine-1-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione |
| Molecular Weight: | 410.94 |
| Molecular Formula: | C18 H19 Cl N2 O3 S2 |
| Smiles: | CCN1CCN(CC1)C(c1cc2CS(c3cc(ccc3c2s1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9596 |
| logD: | 2.7897 |
| logSw: | -3.4302 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.617 |
| InChI Key: | IZVWIAKMJHCLOC-UHFFFAOYSA-N |