N-[(furan-2-yl)methyl]-N-(2-{[4-(4-methoxyphenyl)-1-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N-(2-{[4-(4-methoxyphenyl)-1-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
N-[(furan-2-yl)methyl]-N-(2-{[4-(4-methoxyphenyl)-1-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
Compound ID: | V025-6882 |
Compound Name: | N-[(furan-2-yl)methyl]-N-(2-{[4-(4-methoxyphenyl)-1-phenyl-1H-imidazol-2-yl]amino}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide |
Molecular Weight: | 550.57 |
Molecular Formula: | C31 H26 N4 O6 |
Salt: | not_available |
Smiles: | COc1ccc(cc1)c1cn(c2ccccc2)c(NC(CN(Cc2ccco2)C(c2ccc3c(c2)OCO3)=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 5.1591 |
logD: | 5.1591 |
logSw: | -4.9703 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 84.801 |
InChI Key: | KMDZIWSUVMUUEQ-UHFFFAOYSA-N |