2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
Compound ID: | Y042-3708 |
Compound Name: | 2-(7,8-dimethoxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)acetamide |
Molecular Weight: | 389.43 |
Molecular Formula: | C18 H19 N3 O5 S |
Smiles: | CCc1nnc(NC(CC2=C(C)c3ccc(c(c3OC2=O)OC)OC)=O)s1 |
Stereo: | ACHIRAL |
logP: | 2.8268 |
logD: | 2.7731 |
logSw: | -3.4241 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 83.11 |
InChI Key: | ZRZGKPRADXHJHJ-UHFFFAOYSA-N |