(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 2,2-dimethylpropanoate
Chemical Structure Depiction of
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 2,2-dimethylpropanoate
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | G265-0635 |
| Compound Name: | (4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl 2,2-dimethylpropanoate |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C16 H20 N2 O3 S |
| Smiles: | CC(C)(C)C(=O)OCC1=CC(N2C3CCCCC=3SC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6129 |
| logD: | 2.6129 |
| logSw: | -2.5654 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.504 |
| InChI Key: | KKSUAPKPDZMCNE-UHFFFAOYSA-N |