4-[(2,6-dimethylpyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-[(2,6-dimethylpyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1)
4-[(2,6-dimethylpyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D278-0136 |
| Compound Name: | 4-[(2,6-dimethylpyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 279.72 |
| Molecular Formula: | C13 H13 N3 O2 |
| Salt: | HCl |
| Smiles: | Cc1cc(Nc2ccc(cc2)C(O)=O)nc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.4708 |
| logD: | 2.4708 |
| logSw: | -2.8534 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.117 |
| InChI Key: | DNTSMZBHYGKWCO-UHFFFAOYSA-N |