N-(3-chloro-4-methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
N-(3-chloro-4-methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide
Compound characteristics
Compound ID: | D103-0122 |
Compound Name: | N-(3-chloro-4-methoxyphenyl)-7-methyl-4-oxo-4H-1-benzopyran-2-carboxamide |
Molecular Weight: | 343.76 |
Molecular Formula: | C18 H14 Cl N O4 |
Smiles: | [H]N(C(C1=CC(c2ccc(C)cc2O1)=O)=O)c1ccc(c(c1)[Cl])OC |
Stereo: | ACHIRAL |
logP: | 4.231 |
logD: | 4.2086 |
logSw: | -4.5116 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 52.778 |
InChI Key: | AIXSALALBIEWLV-UHFFFAOYSA-N |