methyl 5-amino-1-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-amino-1-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
methyl 5-amino-1-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | G892-1208 |
| Compound Name: | methyl 5-amino-1-(4-{[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]carbamoyl}phenyl)-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C24 H27 N5 O3 |
| Smiles: | COC(c1cnn(c2ccc(cc2)C(NCCCN2CCc3ccccc3C2)=O)c1N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5225 |
| logD: | 1.3727 |
| logSw: | -2.8592 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.628 |
| InChI Key: | YMSBMUJTDPSAKY-UHFFFAOYSA-N |