N-(4-bromophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
N-(4-bromophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide
Compound characteristics
Compound ID: | K280-0535 |
Compound Name: | N-(4-bromophenyl)-2-({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)acetamide |
Molecular Weight: | 536.45 |
Molecular Formula: | C24 H22 Br N7 O S |
Smiles: | Cc1cc(C)n(CCc2nc3c4ccccc4nc(n3n2)SCC(Nc2ccc(cc2)[Br])=O)n1 |
Stereo: | ACHIRAL |
logP: | 4.2102 |
logD: | 4.1084 |
logSw: | -4.1555 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.922 |
InChI Key: | MTMDNIAWLAIBCP-UHFFFAOYSA-N |