3-[2-(3-chloro-2-methylanilino)-5-ethyl-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[2-(3-chloro-2-methylanilino)-5-ethyl-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
3-[2-(3-chloro-2-methylanilino)-5-ethyl-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K232-1926 |
| Compound Name: | 3-[2-(3-chloro-2-methylanilino)-5-ethyl-1,3-thiazol-4-yl]-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 426.92 |
| Molecular Formula: | C22 H19 Cl N2 O3 S |
| Smiles: | CCc1c(C2=Cc3cccc(c3OC2=O)OC)nc(Nc2cccc(c2C)[Cl])s1 |
| Stereo: | ACHIRAL |
| logP: | 6.453 |
| logD: | 6.453 |
| logSw: | -6.1905 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.235 |
| InChI Key: | ZLKVMFHJBYWXDJ-UHFFFAOYSA-N |