2-[({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)methyl]-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2-[({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)methyl]-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
2-[({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)methyl]-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | C445-0268 |
| Compound Name: | 2-[({2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5-yl}sulfanyl)methyl]-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 556.65 |
| Molecular Formula: | C28 H28 N8 O3 S |
| Smiles: | CC1=CC=CC2=NC(CSc3nc4cc(c(cc4c4nc(CCn5c(C)cc(C)n5)nn34)OC)OC)=CC(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4678 |
| logD: | 2.3508 |
| logSw: | -2.4263 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 85.685 |
| InChI Key: | ZCYVEFKBPCJVBV-UHFFFAOYSA-N |