methyl 5-amino-1-{4-[(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)carbamoyl]phenyl}-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-{4-[(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)carbamoyl]phenyl}-1H-pyrazole-4-carboxylate
methyl 5-amino-1-{4-[(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)carbamoyl]phenyl}-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-1280 |
| Compound Name: | methyl 5-amino-1-{4-[(2-benzyl-2,3-dihydro-1H-isoindol-5-yl)carbamoyl]phenyl}-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 467.53 |
| Molecular Formula: | C27 H25 N5 O3 |
| Smiles: | COC(c1cnn(c2ccc(cc2)C(Nc2ccc3CN(Cc4ccccc4)Cc3c2)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7626 |
| logD: | -0.959 |
| logSw: | -4.0586 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.513 |
| InChI Key: | QWQKMFCFITXICF-UHFFFAOYSA-N |