N-(5-chloro-2,4-dimethoxyphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
N-(5-chloro-2,4-dimethoxyphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide
Compound characteristics
| Compound ID: | L150-0059 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2,8-dimethyl-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-sulfonamide |
| Molecular Weight: | 479.96 |
| Molecular Formula: | C20 H18 Cl N3 O5 S2 |
| Smiles: | CC1=C(C(N2C(=N1)Sc1cc(C)ccc12)=O)S(Nc1cc(c(cc1OC)OC)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5663 |
| logD: | -1.0855 |
| logSw: | -3.8364 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.896 |
| InChI Key: | KIRFCOPTUCDVDT-UHFFFAOYSA-N |