(azepan-1-yl)(7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-yl)methanone
Chemical Structure Depiction of
(azepan-1-yl)(7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-yl)methanone
(azepan-1-yl)(7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-yl)methanone
Compound characteristics
| Compound ID: | C918-0255 |
| Compound Name: | (azepan-1-yl)(7-chloro-4H-thieno[3,2-c][1]benzothiopyran-2-yl)methanone |
| Molecular Weight: | 363.93 |
| Molecular Formula: | C18 H18 Cl N O S2 |
| Smiles: | C1CCCN(CC1)C(c1cc2CSc3cc(ccc3c2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.338 |
| logD: | 5.338 |
| logSw: | -5.9119 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 17.8851 |
| InChI Key: | KCHXWRYCJYGBGC-UHFFFAOYSA-N |