N-(5-chloro-2,4-dimethoxyphenyl)-2-methyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-methyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-methyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
Compound characteristics
| Compound ID: | F441-0004 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-methyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide |
| Molecular Weight: | 465.93 |
| Molecular Formula: | C19 H16 Cl N3 O5 S2 |
| Smiles: | CC1=C(C(N2C(=N1)Sc1ccccc12)=O)S(Nc1cc(c(cc1OC)OC)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9823 |
| logD: | -1.6695 |
| logSw: | -3.5359 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.896 |
| InChI Key: | WVGGDUBEBVHOMK-UHFFFAOYSA-N |