1-{3-[(2,6-dimethylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{3-[(2,6-dimethylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1)
1-{3-[(2,6-dimethylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D278-0522 |
| Compound Name: | 1-{3-[(2,6-dimethylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 277.75 |
| Molecular Formula: | C14 H15 N3 O |
| Salt: | HCl |
| Smiles: | CC(c1cccc(c1)Nc1cc(C)nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3635 |
| logD: | 1.8585 |
| logSw: | -2.9612 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.535 |
| InChI Key: | ANJRHIFWUOEGEZ-UHFFFAOYSA-N |