N-(4-ethylphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
N-(4-ethylphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
Compound characteristics
| Compound ID: | F441-0333 |
| Compound Name: | N-(4-ethylphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C20 H19 N3 O3 S2 |
| Smiles: | CCc1ccc(cc1)NS(C1=C(C)N=C2N(C1=O)c1ccc(C)cc1S2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0601 |
| logD: | 2.9047 |
| logSw: | -3.9739 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.333 |
| InChI Key: | JDAAHZHAVXAUIV-UHFFFAOYSA-N |