methyl 2-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
Chemical Structure Depiction of
methyl 2-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
methyl 2-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | C561-0697 |
| Compound Name: | methyl 2-[3-(5,7-dimethyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)propanamido]benzoate |
| Molecular Weight: | 428.49 |
| Molecular Formula: | C25 H24 N4 O3 |
| Smiles: | Cc1c(CCC(Nc2ccccc2C(=O)OC)=O)c(C)n2c(cc(c3ccccc3)n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0086 |
| logD: | 3.9654 |
| logSw: | -4.3973 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.075 |
| InChI Key: | JDPZTBUKUPINTO-UHFFFAOYSA-N |