N-(4-fluorophenyl)-1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-1H-pyrazole-3-carboxamide
N-(4-fluorophenyl)-1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V030-8437 |
| Compound Name: | N-(4-fluorophenyl)-1-(4-methoxyphenyl)-4-methyl-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 595.61 |
| Molecular Formula: | C28 H26 F N5 O7 S |
| Smiles: | Cc1c(C(Nc2ccc(cc2)F)=O)nn(c2ccc(cc2)OC)c1Oc1ccc(cc1S(N1CCCC1)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1386 |
| logD: | 5.1381 |
| logSw: | -5.0725 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.294 |
| InChI Key: | YKNRMTFNMQKESP-UHFFFAOYSA-N |