3,3'-[(2-phenyl-1,3-oxazole-4,5-diyl)bis(methylenesulfanediyl)]bis(6-methyl-1,2,4-triazin-5(4H)-one)
Chemical Structure Depiction of
3,3'-[(2-phenyl-1,3-oxazole-4,5-diyl)bis(methylenesulfanediyl)]bis(6-methyl-1,2,4-triazin-5(4H)-one)
3,3'-[(2-phenyl-1,3-oxazole-4,5-diyl)bis(methylenesulfanediyl)]bis(6-methyl-1,2,4-triazin-5(4H)-one)
Compound characteristics
| Compound ID: | 8005-5920 |
| Compound Name: | 3,3'-[(2-phenyl-1,3-oxazole-4,5-diyl)bis(methylenesulfanediyl)]bis(6-methyl-1,2,4-triazin-5(4H)-one) |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C19 H17 N7 O3 S2 |
| Smiles: | CC1C(NC(=NN=1)SCc1c(CSC2NC(C(C)=NN=2)=O)oc(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6856 |
| logD: | 2.6093 |
| logSw: | -3.14 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.114 |
| InChI Key: | NWPMJKFHMLAYOM-UHFFFAOYSA-N |