2-({8,9-dimethoxy-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-ethyl-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
2-({8,9-dimethoxy-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-ethyl-N-(3-methylphenyl)acetamide
2-({8,9-dimethoxy-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-ethyl-N-(3-methylphenyl)acetamide
Compound characteristics
Compound ID: | C445-0304 |
Compound Name: | 2-({8,9-dimethoxy-2-[2-(2-methyl-1H-benzimidazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-ethyl-N-(3-methylphenyl)acetamide |
Molecular Weight: | 595.72 |
Molecular Formula: | C32 H33 N7 O3 S |
Smiles: | CCN(C(CSc1nc2cc(c(cc2c2nc(CCn3c4ccccc4nc3C)nn12)OC)OC)=O)c1cccc(C)c1 |
Stereo: | ACHIRAL |
logP: | 5.4436 |
logD: | 5.3282 |
logSw: | -5.3964 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 72.095 |
InChI Key: | DCPBBGSCKNBIFN-UHFFFAOYSA-N |