5-methyl-N-{3-[3-methyl-5-(propan-2-yl)phenoxy]-5-nitrophenyl}-1,3-diphenyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
5-methyl-N-{3-[3-methyl-5-(propan-2-yl)phenoxy]-5-nitrophenyl}-1,3-diphenyl-1H-pyrazole-4-carboxamide
5-methyl-N-{3-[3-methyl-5-(propan-2-yl)phenoxy]-5-nitrophenyl}-1,3-diphenyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | 8004-9846 |
| Compound Name: | 5-methyl-N-{3-[3-methyl-5-(propan-2-yl)phenoxy]-5-nitrophenyl}-1,3-diphenyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 546.63 |
| Molecular Formula: | C33 H30 N4 O4 |
| Smiles: | CC(C)c1cc(C)cc(c1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1c(c2ccccc2)nn(c2ccccc2)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 8.1093 |
| logD: | 8.1078 |
| logSw: | -5.7283 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.799 |
| InChI Key: | IIZYGXCACAKVHU-UHFFFAOYSA-N |