N-{3-[3-(diethylamino)phenoxy]-5-nitrophenyl}-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-{3-[3-(diethylamino)phenoxy]-5-nitrophenyl}-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide
N-{3-[3-(diethylamino)phenoxy]-5-nitrophenyl}-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | K061-1039 |
| Compound Name: | N-{3-[3-(diethylamino)phenoxy]-5-nitrophenyl}-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 561.64 |
| Molecular Formula: | C33 H31 N5 O4 |
| Smiles: | CCN(CC)c1cccc(c1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1c(c2ccccc2)nn(c2ccccc2)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.344 |
| logD: | 7.342 |
| logSw: | -5.7275 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.535 |
| InChI Key: | BJCCSTVTBVMTGK-UHFFFAOYSA-N |