5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Chemical Structure Depiction of
5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-methyl-1H-pyrazole-4-carboxylic acid
5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-methyl-1H-pyrazole-4-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8432 |
| Compound Name: | 5-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-methyl-1H-pyrazole-4-carboxylic acid |
| Molecular Weight: | 285.3 |
| Molecular Formula: | C15 H15 N3 O3 |
| Smiles: | Cn1c(C(N2CCc3ccccc3C2)=O)c(cn1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5167 |
| logD: | -2.0581 |
| logSw: | -2.0273 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.472 |
| InChI Key: | OFQGCPUDMIDMHB-UHFFFAOYSA-N |