5-{[(4-tert-butylphenyl)methyl]sulfanyl}-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
5-{[(4-tert-butylphenyl)methyl]sulfanyl}-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline
5-{[(4-tert-butylphenyl)methyl]sulfanyl}-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | K280-0321 |
| Compound Name: | 5-{[(4-tert-butylphenyl)methyl]sulfanyl}-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 470.64 |
| Molecular Formula: | C27 H30 N6 S |
| Smiles: | Cc1cc(C)n(CCc2nc3c4ccccc4nc(n3n2)SCc2ccc(cc2)C(C)(C)C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4953 |
| logD: | 5.2814 |
| logSw: | -5.8193 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.773 |
| InChI Key: | WDEODQWMTJDFOI-UHFFFAOYSA-N |