(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (3,4-dimethylphenoxy)acetate
Chemical Structure Depiction of
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (3,4-dimethylphenoxy)acetate
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (3,4-dimethylphenoxy)acetate
Compound characteristics
| Compound ID: | G265-0646 |
| Compound Name: | (4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (3,4-dimethylphenoxy)acetate |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | Cc1ccc(cc1C)OCC(=O)OCC1=CC(N2C3CCCCC=3SC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4315 |
| logD: | 3.4315 |
| logSw: | -3.6763 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.137 |
| InChI Key: | TYLAOIDFYXXPKI-UHFFFAOYSA-N |