3-chloro-N-{[(4,6-dimethylpyrimidin-2-yl)amino](2-propoxyanilino)methylidene}-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-{[(4,6-dimethylpyrimidin-2-yl)amino](2-propoxyanilino)methylidene}-1-benzothiophene-2-carboxamide
3-chloro-N-{[(4,6-dimethylpyrimidin-2-yl)amino](2-propoxyanilino)methylidene}-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 4477-2249 |
| Compound Name: | 3-chloro-N-{[(4,6-dimethylpyrimidin-2-yl)amino](2-propoxyanilino)methylidene}-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 494.01 |
| Molecular Formula: | C25 H24 Cl N5 O2 S |
| Smiles: | CCCOc1ccccc1N/C(Nc1nc(C)cc(C)n1)=N/C(c1c(c2ccccc2s1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4208 |
| logD: | 4.8893 |
| logSw: | -6.3518 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.401 |
| InChI Key: | YEMPJKBRFLVQMH-UHFFFAOYSA-N |