4-bromo-N-{2-[6-methyl-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}benzamide
Chemical Structure Depiction of
4-bromo-N-{2-[6-methyl-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}benzamide
4-bromo-N-{2-[6-methyl-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}benzamide
Compound characteristics
Compound ID: | G856-8183 |
Compound Name: | 4-bromo-N-{2-[6-methyl-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl}benzamide |
Molecular Weight: | 455.37 |
Molecular Formula: | C21 H19 Br N4 O S |
Smiles: | Cc1ccc(cc1)c1nc2n(c(C)c(CCNC(c3ccc(cc3)[Br])=O)s2)n1 |
Stereo: | ACHIRAL |
logP: | 5.0411 |
logD: | 5.0408 |
logSw: | -4.557 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 45.963 |
InChI Key: | MDLCVTKNLCZBON-UHFFFAOYSA-N |