2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]acetamide
2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | K784-2896 |
| Compound Name: | 2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]acetamide |
| Molecular Weight: | 522.63 |
| Molecular Formula: | C29 H26 N6 O2 S |
| Smiles: | CC1=CC=CC2=NC(CNC(CSc3nc(c4ccc(C)cc4)c(c4ccc(C)cc4)nn3)=O)=CC(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1118 |
| logD: | 4.1118 |
| logSw: | -4.1464 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.508 |
| InChI Key: | NUIZPTAZAPLREE-UHFFFAOYSA-N |