3-methyl-N-(4-oxo-8-propoxy-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)benzamide
Chemical Structure Depiction of
3-methyl-N-(4-oxo-8-propoxy-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)benzamide
3-methyl-N-(4-oxo-8-propoxy-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)benzamide
Compound characteristics
| Compound ID: | 8629-0055 |
| Compound Name: | 3-methyl-N-(4-oxo-8-propoxy-4H-pyrimido[2,1-b][1,3]benzothiazol-3-yl)benzamide |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C21 H19 N3 O3 S |
| Smiles: | CCCOc1ccc2c(c1)SC1=NC=C(C(N12)=O)NC(c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6933 |
| logD: | 3.6234 |
| logSw: | -3.9319 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.493 |
| InChI Key: | LCEDKYFUGHAAFL-UHFFFAOYSA-N |