5-(adamantan-1-yl)-3-[(dibenzylamino)methyl]benzene-1,2-diol--hydrogen chloride (1/1)
Chemical Structure Depiction of
5-(adamantan-1-yl)-3-[(dibenzylamino)methyl]benzene-1,2-diol--hydrogen chloride (1/1)
5-(adamantan-1-yl)-3-[(dibenzylamino)methyl]benzene-1,2-diol--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D090-0094 |
| Compound Name: | 5-(adamantan-1-yl)-3-[(dibenzylamino)methyl]benzene-1,2-diol--hydrogen chloride (1/1) |
| Molecular Weight: | 490.09 |
| Molecular Formula: | C31 H35 N O2 |
| Salt: | HCl |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1cc(CN(Cc2ccccc2)Cc2ccccc2)c(c(c1)O)O |
| Stereo: | ACHIRAL |
| logP: | 7.5815 |
| logD: | 5.1908 |
| logSw: | -6.0498 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 35.468 |
| InChI Key: | NOYWKGMWVHQTCI-UHFFFAOYSA-N |