N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}thiophene-2-carboxamide
N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y021-1563 |
| Compound Name: | N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}thiophene-2-carboxamide |
| Molecular Weight: | 415.9 |
| Molecular Formula: | C19 H18 Cl N5 O2 S |
| Smiles: | Cc1cc(C)nc(NC(\Nc2cc(ccc2OC)[Cl])=N/C(c2cccs2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0052 |
| logD: | 3.3492 |
| logSw: | -4.4304 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.798 |
| InChI Key: | GRRVQOYHWDXMGK-UHFFFAOYSA-N |