(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl diphenylacetate
Chemical Structure Depiction of
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl diphenylacetate
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl diphenylacetate
Compound characteristics
| Compound ID: | G265-0679 |
| Compound Name: | (4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl diphenylacetate |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C25 H22 N2 O3 S |
| Smiles: | C1CCC2=C(C1)N1C(=NC(COC(C(c3ccccc3)c3ccccc3)=O)=CC1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 4.3675 |
| logD: | 4.3675 |
| logSw: | -4.4964 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.961 |
| InChI Key: | YDQUCJLPJTXFLA-UHFFFAOYSA-N |