2,4-dichloro-N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Chemical Structure Depiction of
2,4-dichloro-N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
2,4-dichloro-N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Compound characteristics
Compound ID: | F019-5789 |
Compound Name: | 2,4-dichloro-N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide |
Molecular Weight: | 418.3 |
Molecular Formula: | C18 H13 Cl2 N5 O S |
Smiles: | CCc1nnc2n1nc(c1ccc(cc1)NC(c1ccc(cc1[Cl])[Cl])=O)s2 |
Stereo: | ACHIRAL |
logP: | 4.31 |
logD: | 4.3081 |
logSw: | -4.5766 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.061 |
InChI Key: | UXQJLJYKTPFCPJ-UHFFFAOYSA-N |