propyl 4-[(6-methylpyrimidin-4-yl)amino]benzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
propyl 4-[(6-methylpyrimidin-4-yl)amino]benzoate--hydrogen chloride (1/1)
propyl 4-[(6-methylpyrimidin-4-yl)amino]benzoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D278-0179 |
| Compound Name: | propyl 4-[(6-methylpyrimidin-4-yl)amino]benzoate--hydrogen chloride (1/1) |
| Molecular Weight: | 307.78 |
| Molecular Formula: | C15 H17 N3 O2 |
| Salt: | HCl |
| Smiles: | CCCOC(c1ccc(cc1)Nc1cc(C)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7156 |
| logD: | 3.6124 |
| logSw: | -3.8364 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.382 |
| InChI Key: | WOIQCBXQKVSKOD-UHFFFAOYSA-N |