7-chloro-2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione
Chemical Structure Depiction of
7-chloro-2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione
7-chloro-2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione
Compound characteristics
| Compound ID: | C918-0181 |
| Compound Name: | 7-chloro-2-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-5lambda~6~-thieno[3,2-c][1]benzothiopyran-5,5(4H)-dione |
| Molecular Weight: | 455.98 |
| Molecular Formula: | C23 H18 Cl N O3 S2 |
| Smiles: | C1CN(CC=C1c1ccccc1)C(c1cc2CS(c3cc(ccc3c2s1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3325 |
| logD: | 5.3325 |
| logSw: | -5.892 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.808 |
| InChI Key: | YBTZYWJKEFOTTP-UHFFFAOYSA-N |