5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one
Chemical Structure Depiction of
5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one
5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one
Compound characteristics
| Compound ID: | 6737-0617 |
| Compound Name: | 5-amino-3-[(2-methylprop-2-en-1-yl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidin-7(8H)-one |
| Molecular Weight: | 237.28 |
| Molecular Formula: | C9 H11 N5 O S |
| Smiles: | CC(=C)CSc1nnc2NC(C=C(N)n12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0537 |
| logD: | 0.8378 |
| logSw: | -1.5021 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.338 |
| InChI Key: | KQBGLDGHXDDYHO-UHFFFAOYSA-N |