7-bromo-2-[({6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-bromo-2-[({6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
7-bromo-2-[({6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | K784-6146 |
| Compound Name: | 7-bromo-2-[({6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 535.46 |
| Molecular Formula: | C25 H23 Br N6 O S |
| Smiles: | Cc1ccc(C)c(Cc2c(C)nc3nc(nn3c2C)SCC2=CC(N3C=C(C=CC3=N2)[Br])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.6466 |
| logD: | 4.6466 |
| logSw: | -4.57 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.06 |
| InChI Key: | ZIESBRFLULDFLQ-UHFFFAOYSA-N |