N-[(3-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,5-dimethoxyaniline--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[(3-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,5-dimethoxyaniline--hydrogen chloride (1/1)
N-[(3-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,5-dimethoxyaniline--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | C301-5630 |
Compound Name: | N-[(3-chlorophenyl)(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-3,5-dimethoxyaniline--hydrogen chloride (1/1) |
Molecular Weight: | 458.34 |
Molecular Formula: | C23 H20 Cl N3 O3 |
Salt: | HCl |
Smiles: | COc1cc(cc(c1)OC)NC(c1cccc(c1)[Cl])c1nnc(c2ccccc2)o1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.4582 |
logD: | 5.4582 |
logSw: | -6.1573 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.157 |
InChI Key: | XYTAMGVJIBOXQW-OAQYLSRUSA-N |