N~1~,N~1~-diethyl-N~3~-{[4-(hexyloxy)phenyl]methyl}propane-1,3-diamine--oxalic acid (1/1)
Chemical Structure Depiction of
N~1~,N~1~-diethyl-N~3~-{[4-(hexyloxy)phenyl]methyl}propane-1,3-diamine--oxalic acid (1/1)
N~1~,N~1~-diethyl-N~3~-{[4-(hexyloxy)phenyl]methyl}propane-1,3-diamine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | K786-4779 |
| Compound Name: | N~1~,N~1~-diethyl-N~3~-{[4-(hexyloxy)phenyl]methyl}propane-1,3-diamine--oxalic acid (1/1) |
| Molecular Weight: | 410.55 |
| Molecular Formula: | C20 H36 N2 O |
| Salt: | HOOCCOOH |
| Smiles: | CCCCCCOc1ccc(CNCCCN(CC)CC)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5149 |
| logD: | 2.2904 |
| logSw: | -3.9356 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.9461 |
| InChI Key: | ZQUWVICWDZWOJH-UHFFFAOYSA-N |