3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1)
3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 4790-1116 |
| Compound Name: | 3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]benzoic acid--hydrogen chloride (1/1) |
| Molecular Weight: | 335.81 |
| Molecular Formula: | C15 H13 N3 O2 S |
| Salt: | HCl |
| Smiles: | Cc1c2c(Nc3cccc(c3)C(O)=O)ncnc2sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.3387 |
| logD: | 1.0444 |
| logSw: | -4.5055 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.113 |
| InChI Key: | JVLAOJFMJWITIO-UHFFFAOYSA-N |