4-{6-[(4-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}-N,N-dimethylaniline
Chemical Structure Depiction of
4-{6-[(4-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}-N,N-dimethylaniline
4-{6-[(4-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}-N,N-dimethylaniline
Compound characteristics
| Compound ID: | D727-0037 |
| Compound Name: | 4-{6-[(4-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}-N,N-dimethylaniline |
| Molecular Weight: | 385.87 |
| Molecular Formula: | C18 H16 Cl N5 O S |
| Smiles: | CN(C)c1ccc(cc1)c1nnc2n1nc(COc1ccc(cc1)[Cl])s2 |
| Stereo: | ACHIRAL |
| logP: | 4.1289 |
| logD: | 4.1288 |
| logSw: | -4.5166 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 44.521 |
| InChI Key: | PTQINRWHAHUUPE-UHFFFAOYSA-N |