4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide
Chemical Structure Depiction of
4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide
4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide
Compound characteristics
Compound ID: | K784-1433 |
Compound Name: | 4-({3-[benzyl(methyl)amino]propyl}amino)-3-nitro-N-[4-(propan-2-yl)phenyl]benzamide |
Molecular Weight: | 460.58 |
Molecular Formula: | C27 H32 N4 O3 |
Smiles: | CC(C)c1ccc(cc1)NC(c1ccc(c(c1)[N+]([O-])=O)NCCCN(C)Cc1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.7312 |
logD: | 4.8735 |
logSw: | -5.4183 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 69.883 |
InChI Key: | HLTMPDUVSRYOQW-UHFFFAOYSA-N |