4-oxo-N-[2-(thiophen-2-yl)ethyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
4-oxo-N-[2-(thiophen-2-yl)ethyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
4-oxo-N-[2-(thiophen-2-yl)ethyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
Compound ID: | G595-0289 |
Compound Name: | 4-oxo-N-[2-(thiophen-2-yl)ethyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
Molecular Weight: | 359.47 |
Molecular Formula: | C17 H17 N3 O2 S2 |
Smiles: | C1CCC2=C(C1)N1C(=NC=C(C(NCCc3cccs3)=O)C1=O)S2 |
Stereo: | ACHIRAL |
logP: | 1.7744 |
logD: | 1.7729 |
logSw: | -2.3247 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.897 |
InChI Key: | OGNNLSXHEMUFKB-UHFFFAOYSA-N |