N-[3-(4-iodophenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-[3-(4-iodophenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide
N-[3-(4-iodophenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | K061-1041 |
| Compound Name: | N-[3-(4-iodophenoxy)-5-nitrophenyl]-5-methyl-1,3-diphenyl-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 616.41 |
| Molecular Formula: | C29 H21 I N4 O4 |
| Smiles: | Cc1c(C(Nc2cc(cc(c2)Oc2ccc(cc2)I)[N+]([O-])=O)=O)c(c2ccccc2)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.8251 |
| logD: | 7.8237 |
| logSw: | -5.7698 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.799 |
| InChI Key: | YWBCVMZQQZBFMU-UHFFFAOYSA-N |