4-oxo-N-[(3,4,5-triethoxyphenyl)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
4-oxo-N-[(3,4,5-triethoxyphenyl)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
4-oxo-N-[(3,4,5-triethoxyphenyl)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | G595-0044 |
| Compound Name: | 4-oxo-N-[(3,4,5-triethoxyphenyl)methyl]-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
| Molecular Weight: | 471.57 |
| Molecular Formula: | C24 H29 N3 O5 S |
| Smiles: | CCOc1cc(CNC(C2=CN=C3N(C4CCCCC=4S3)C2=O)=O)cc(c1OCC)OCC |
| Stereo: | ACHIRAL |
| logP: | 2.6222 |
| logD: | 2.6217 |
| logSw: | -2.9456 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.754 |
| InChI Key: | QBDLXKYGWLWORR-UHFFFAOYSA-N |