(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl thiophene-2-carboxylate
Chemical Structure Depiction of
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl thiophene-2-carboxylate
(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G265-0625 |
| Compound Name: | (4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl thiophene-2-carboxylate |
| Molecular Weight: | 346.42 |
| Molecular Formula: | C16 H14 N2 O3 S2 |
| Smiles: | C1CCC2=C(C1)N1C(=NC(COC(c3cccs3)=O)=CC1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 2.6487 |
| logD: | 2.6487 |
| logSw: | -2.8274 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.251 |
| InChI Key: | MRFXROWLYPRCDB-UHFFFAOYSA-N |