N~1~,N~1~-diethyl-N~3~-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)propane-1,3-diamine--oxalic acid (1/1)
Chemical Structure Depiction of
N~1~,N~1~-diethyl-N~3~-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)propane-1,3-diamine--oxalic acid (1/1)
N~1~,N~1~-diethyl-N~3~-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)propane-1,3-diamine--oxalic acid (1/1)
Compound characteristics
Compound ID: | K786-4780 |
Compound Name: | N~1~,N~1~-diethyl-N~3~-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methyl)propane-1,3-diamine--oxalic acid (1/1) |
Molecular Weight: | 398.5 |
Molecular Formula: | C18 H32 N2 O2 |
Salt: | HOOCCOOH |
Smiles: | CCN(CC)CCCNCc1ccc(c(c1)OC)OC(C)C |
Stereo: | ACHIRAL |
logP: | 2.3685 |
logD: | -0.2467 |
logSw: | -2.6291 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 30.0481 |
InChI Key: | NIEQUIUJRFUNNB-UHFFFAOYSA-N |