2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline
2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | C445-0329 |
| Compound Name: | 2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy-5-{[(3-methoxyphenyl)methyl]sulfanyl}[1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 504.61 |
| Molecular Formula: | C26 H28 N6 O3 S |
| Smiles: | Cc1cc(C)n(CCc2nc3c4cc(c(cc4nc(n3n2)SCc2cccc(c2)OC)OC)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7221 |
| logD: | 3.48 |
| logSw: | -4.0254 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.577 |
| InChI Key: | MQOUSAWRBAZZNL-UHFFFAOYSA-N |