methyl 3-{[7-ethyl-2-(pyridin-2-yl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[7-ethyl-2-(pyridin-2-yl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]amino}benzoate
methyl 3-{[7-ethyl-2-(pyridin-2-yl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | P645-1231 |
| Compound Name: | methyl 3-{[7-ethyl-2-(pyridin-2-yl)pyrazolo[1,5-a]pyrimidine-5-carbonyl]amino}benzoate |
| Molecular Weight: | 401.42 |
| Molecular Formula: | C22 H19 N5 O3 |
| Smiles: | CCc1cc(C(Nc2cccc(c2)C(=O)OC)=O)nc2cc(c3ccccn3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 3.827 |
| logD: | 3.8264 |
| logSw: | -3.9771 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.191 |
| InChI Key: | FQUAWSPLFBIJRA-UHFFFAOYSA-N |