6-amino-2-[(2-phenylethenyl)sulfanyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-amino-2-[(2-phenylethenyl)sulfanyl]pyrimidin-4(3H)-one
6-amino-2-[(2-phenylethenyl)sulfanyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 8012-7635 |
| Compound Name: | 6-amino-2-[(2-phenylethenyl)sulfanyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 245.3 |
| Molecular Formula: | C12 H11 N3 O S |
| Smiles: | C(=C/SC1NC(C=C(N)N=1)=O)\c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6045 |
| logD: | 1.601 |
| logSw: | -2.1257 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 54.681 |
| InChI Key: | XPIRXVHKXUKITM-UHFFFAOYSA-N |