4-{3-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}-N,N-dimethylaniline
Chemical Structure Depiction of
4-{3-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}-N,N-dimethylaniline
4-{3-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}-N,N-dimethylaniline
Compound characteristics
Compound ID: | D727-0469 |
Compound Name: | 4-{3-[(4-methoxyphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}-N,N-dimethylaniline |
Molecular Weight: | 381.45 |
Molecular Formula: | C19 H19 N5 O2 S |
Smiles: | CN(C)c1ccc(cc1)c1nn2c(COc3ccc(cc3)OC)nnc2s1 |
Stereo: | ACHIRAL |
logP: | 3.2003 |
logD: | 3.2002 |
logSw: | -3.3475 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 52.545 |
InChI Key: | XEGYKJJRTUVBNJ-UHFFFAOYSA-N |