2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)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-(2,4,6-trimethylphenyl)acetamide
2-({2-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl][1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
| Compound ID: | K280-0574 |
| 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-(2,4,6-trimethylphenyl)acetamide |
| Molecular Weight: | 499.64 |
| Molecular Formula: | C27 H29 N7 O S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(CSc1nc2ccccc2c2nc(CCc3c(C)n[nH]c3C)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.772 |
| logD: | 4.1992 |
| logSw: | -4.7439 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.456 |
| InChI Key: | KQEKQDYHMFJEGZ-UHFFFAOYSA-N |