2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | C679-3868 |
| Compound Name: | 2-{[2-(prop-2-en-1-yl)phenoxy]methyl}-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 352.45 |
| Molecular Formula: | C20 H20 N2 O2 S |
| Smiles: | C=CCc1ccccc1OCC1=CC(N2C3CCCCC=3SC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8397 |
| logD: | 3.8397 |
| logSw: | -4.1346 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.689 |
| InChI Key: | OPZNRJGDEASPJE-UHFFFAOYSA-N |