N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide
N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
Compound ID: | G411-0030 |
Compound Name: | N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-2H-1,3-benzodioxole-5-carboxamide |
Molecular Weight: | 406.44 |
Molecular Formula: | C23 H22 N2 O5 |
Smiles: | C1CCC(CC1)NC1=C(C(=O)Oc2ccccc12)NC(c1ccc2c(c1)OCO2)=O |
Stereo: | ACHIRAL |
logP: | 3.8824 |
logD: | 3.7828 |
logSw: | -4.1138 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.725 |
InChI Key: | NWCNHCKFXNISNC-UHFFFAOYSA-N |