2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Chemical Structure Depiction of
2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide
2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide
Compound characteristics
| Compound ID: | K280-0559 |
| Compound Name: | 2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(3-methyl-1H-pyrazol-5-yl)acetamide |
| Molecular Weight: | 461.55 |
| Molecular Formula: | C22 H23 N9 O S |
| Smiles: | Cc1cc(NC(CSc2nc3ccccc3c3nc(CCc4c(C)n[nH]c4C)nn23)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7275 |
| logD: | 2.1548 |
| logSw: | -3.212 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.987 |
| InChI Key: | RRHYKTFVMRAHQV-UHFFFAOYSA-N |