3-(1,3-benzothiazol-2-yl)-8-[(diethylamino)methyl]-6-ethyl-7-hydroxy-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-8-[(diethylamino)methyl]-6-ethyl-7-hydroxy-4H-1-benzopyran-4-one
3-(1,3-benzothiazol-2-yl)-8-[(diethylamino)methyl]-6-ethyl-7-hydroxy-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 3570-0069 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-8-[(diethylamino)methyl]-6-ethyl-7-hydroxy-4H-1-benzopyran-4-one |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C23 H24 N2 O3 S |
| Smiles: | CCc1cc2C(C(=COc2c(CN(CC)CC)c1O)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0843 |
| logD: | 3.7475 |
| logSw: | -4.7172 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.177 |
| InChI Key: | WPKYIRQWHZSCGE-UHFFFAOYSA-N |