N-[2-(3,4-dimethoxyphenyl)ethyl]-8-methoxy-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-methoxy-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-8-methoxy-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide
Compound characteristics
| Compound ID: | C797-1064 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-8-methoxy-4-oxo-4H-pyrimido[2,1-b][1,3]benzothiazole-3-carboxamide |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C22 H21 N3 O5 S |
| Smiles: | COc1ccc2c(c1)SC1=NC=C(C(NCCc3ccc(c(c3)OC)OC)=O)C(N12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6822 |
| logD: | 1.6808 |
| logSw: | -2.4659 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.081 |
| InChI Key: | QIADEHCUNVZSEI-UHFFFAOYSA-N |