{1-[(2-chloro-4-nitrophenoxy)methyl]-1H-pyrazol-3-yl}(6-methyl-3,4-dihydroquinolin-1(2H)-yl)methanone
Chemical Structure Depiction of
{1-[(2-chloro-4-nitrophenoxy)methyl]-1H-pyrazol-3-yl}(6-methyl-3,4-dihydroquinolin-1(2H)-yl)methanone
{1-[(2-chloro-4-nitrophenoxy)methyl]-1H-pyrazol-3-yl}(6-methyl-3,4-dihydroquinolin-1(2H)-yl)methanone
Compound characteristics
| Compound ID: | Y502-3661 |
| Compound Name: | {1-[(2-chloro-4-nitrophenoxy)methyl]-1H-pyrazol-3-yl}(6-methyl-3,4-dihydroquinolin-1(2H)-yl)methanone |
| Molecular Weight: | 426.86 |
| Molecular Formula: | C21 H19 Cl N4 O4 |
| Smiles: | Cc1ccc2c(CCCN2C(c2ccn(COc3ccc(cc3[Cl])[N+]([O-])=O)n2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.27 |
| logD: | 4.27 |
| logSw: | -4.6015 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.383 |
| InChI Key: | GYXDQFGTMUIZEF-UHFFFAOYSA-N |