methyl 3-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate
Chemical Structure Depiction of
methyl 3-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate
methyl 3-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate
Compound characteristics
Compound ID: | G411-0231 |
Compound Name: | methyl 3-{[4-(benzylamino)-2-oxo-2H-1-benzopyran-3-yl]amino}-3-oxopropanoate |
Molecular Weight: | 366.37 |
Molecular Formula: | C20 H18 N2 O5 |
Smiles: | COC(CC(NC1=C(c2ccccc2OC1=O)NCc1ccccc1)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.4076 |
logD: | 0.5905 |
logSw: | -2.0578 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.521 |
InChI Key: | ZUTMEOOUBKMRDV-UHFFFAOYSA-N |