1-{3-[(6-phenylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{3-[(6-phenylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1)
1-{3-[(6-phenylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D278-0523 |
| Compound Name: | 1-{3-[(6-phenylpyrimidin-4-yl)amino]phenyl}ethan-1-one--hydrogen chloride (1/1) |
| Molecular Weight: | 325.8 |
| Molecular Formula: | C18 H15 N3 O |
| Salt: | HCl |
| Smiles: | CC(c1cccc(c1)Nc1cc(c2ccccc2)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0704 |
| logD: | 3.9752 |
| logSw: | -4.1498 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.083 |
| InChI Key: | BHZJKJKJHHGXSD-UHFFFAOYSA-N |