(3,4-dihydroisoquinolin-2(1H)-yl)(1-ethyl-4-nitro-1H-pyrazol-5-yl)methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)(1-ethyl-4-nitro-1H-pyrazol-5-yl)methanone
(3,4-dihydroisoquinolin-2(1H)-yl)(1-ethyl-4-nitro-1H-pyrazol-5-yl)methanone
Compound characteristics
| Compound ID: | Y508-7928 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)(1-ethyl-4-nitro-1H-pyrazol-5-yl)methanone |
| Molecular Weight: | 300.31 |
| Molecular Formula: | C15 H16 N4 O3 |
| Smiles: | CCn1c(C(N2CCc3ccccc3C2)=O)c(cn1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9254 |
| logD: | 1.9254 |
| logSw: | -2.0959 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.584 |
| InChI Key: | GQJXSTMMFQSOOM-UHFFFAOYSA-N |