(2-chlorophenyl)[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
(2-chlorophenyl)[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone
(2-chlorophenyl)[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
Compound ID: | D331-0252 |
Compound Name: | (2-chlorophenyl)[5-({[4-(dimethylamino)phenyl]methyl}amino)-3-(furan-2-yl)-1H-1,2,4-triazol-1-yl]methanone |
Molecular Weight: | 421.88 |
Molecular Formula: | C22 H20 Cl N5 O2 |
Smiles: | CN(C)c1ccc(CNc2nc(c3ccco3)nn2C(c2ccccc2[Cl])=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.7997 |
logD: | 3.7843 |
logSw: | -4.2356 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.61 |
InChI Key: | WVBPOVQOCKHOHU-UHFFFAOYSA-N |