N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-3,4,5-triethoxybenzamide
Chemical Structure Depiction of
N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-3,4,5-triethoxybenzamide
N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-3,4,5-triethoxybenzamide
Compound characteristics
Compound ID: | G411-0035 |
Compound Name: | N-[4-(cyclohexylamino)-2-oxo-2H-1-benzopyran-3-yl]-3,4,5-triethoxybenzamide |
Molecular Weight: | 494.59 |
Molecular Formula: | C28 H34 N2 O6 |
Smiles: | CCOc1cc(cc(c1OCC)OCC)C(NC1=C(c2ccccc2OC1=O)NC1CCCCC1)=O |
Stereo: | ACHIRAL |
logP: | 4.6995 |
logD: | 4.6727 |
logSw: | -4.4997 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 76.327 |
InChI Key: | GSHMXNJQEIXELM-UHFFFAOYSA-N |