(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2-chlorophenoxy)acetate
Chemical Structure Depiction of
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2-chlorophenoxy)acetate
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2-chlorophenoxy)acetate
Compound characteristics
| Compound ID: | G265-0650 |
| Compound Name: | (4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl (2-chlorophenoxy)acetate |
| Molecular Weight: | 404.87 |
| Molecular Formula: | C19 H17 Cl N2 O4 S |
| Smiles: | C1CCC2=C(C1)N1C(=NC(COC(COc3ccccc3[Cl])=O)=CC1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 2.7898 |
| logD: | 2.7898 |
| logSw: | -3.3538 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.223 |
| InChI Key: | PETHWZAOCAJBRE-UHFFFAOYSA-N |