N-(6-chloro-1,3-benzothiazol-2-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(6-chloro-1,3-benzothiazol-2-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-(6-chloro-1,3-benzothiazol-2-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
Compound ID: | D103-1116 |
Compound Name: | N-(6-chloro-1,3-benzothiazol-2-yl)-6-methyl-4-oxo-4H-1-benzopyran-2-carboxamide |
Molecular Weight: | 370.81 |
Molecular Formula: | C18 H11 Cl N2 O3 S |
Smiles: | Cc1ccc2c(c1)C(C=C(C(Nc1nc3ccc(cc3s1)[Cl])=O)O2)=O |
Stereo: | ACHIRAL |
logP: | 5.0756 |
logD: | 5.0458 |
logSw: | -5.0728 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.909 |
InChI Key: | ZGGBAIKVDTVUKS-UHFFFAOYSA-N |