3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate
3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | K277-0040 |
| Compound Name: | 3-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-oxo-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 432.28 |
| Molecular Formula: | C20 H11 Cl2 N O4 S |
| Smiles: | CC(=O)Oc1ccc2C=C(C(=O)Oc2c1)c1nc(cs1)c1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.4608 |
| logD: | 5.4608 |
| logSw: | -6.0968 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.374 |
| InChI Key: | QFHLRYYIRIGWKQ-UHFFFAOYSA-N |