(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl [(4-methylphenyl)sulfanyl]acetate
Chemical Structure Depiction of
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl [(4-methylphenyl)sulfanyl]acetate
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl [(4-methylphenyl)sulfanyl]acetate
Compound characteristics
| Compound ID: | G265-0653 |
| Compound Name: | (4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl [(4-methylphenyl)sulfanyl]acetate |
| Molecular Weight: | 400.52 |
| Molecular Formula: | C20 H20 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)SCC(=O)OCC1=CC(N2C3CCCCC=3SC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6318 |
| logD: | 3.6318 |
| logSw: | -3.8172 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 46.638 |
| InChI Key: | FMGICXXRDDWOJM-UHFFFAOYSA-N |