4-methyl-1-(4-methylphenyl)-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-(propan-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-methyl-1-(4-methylphenyl)-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-(propan-2-yl)-1H-pyrazole-3-carboxamide
4-methyl-1-(4-methylphenyl)-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-(propan-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | V030-4870 |
| Compound Name: | 4-methyl-1-(4-methylphenyl)-5-[4-nitro-2-(pyrrolidine-1-sulfonyl)phenoxy]-N-(propan-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 527.6 |
| Molecular Formula: | C25 H29 N5 O6 S |
| Salt: | not_available |
| Smiles: | CC(C)NC(c1c(C)c(n(c2ccc(C)cc2)n1)Oc1ccc(cc1S(N1CCCC1)(=O)=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2587 |
| logD: | 4.2587 |
| logSw: | -4.3163 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.318 |
| InChI Key: | OMYZHVGVEHFISZ-UHFFFAOYSA-N |