6-amino-2-[(prop-2-yn-1-yl)sulfanyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-amino-2-[(prop-2-yn-1-yl)sulfanyl]pyrimidin-4(3H)-one
6-amino-2-[(prop-2-yn-1-yl)sulfanyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | Y010-1483 |
| Compound Name: | 6-amino-2-[(prop-2-yn-1-yl)sulfanyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 181.21 |
| Molecular Formula: | C7 H7 N3 O S |
| Smiles: | C#CCSC1NC(C=C(N)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.1632 |
| logD: | -0.168 |
| logSw: | -1.8915 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 54.953 |
| InChI Key: | CYRHUKQVXWTRFJ-UHFFFAOYSA-N |