N~2~-[(furan-2-yl)methyl]-N~4~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Chemical Structure Depiction of
N~2~-[(furan-2-yl)methyl]-N~4~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
N~2~-[(furan-2-yl)methyl]-N~4~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine
Compound characteristics
Compound ID: | G786-0123 |
Compound Name: | N~2~-[(furan-2-yl)methyl]-N~4~-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine |
Molecular Weight: | 356.34 |
Molecular Formula: | C16 H16 N6 O4 |
Smiles: | COc1ccc(cc1)Nc1c(c(N)nc(NCc2ccco2)n1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.3191 |
logD: | 3.3187 |
logSw: | -3.7712 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 108.499 |
InChI Key: | WYPXDZCLCFKARD-UHFFFAOYSA-N |