N-tert-butyl-2-{[1-(4-methoxyphenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-tert-butyl-2-{[1-(4-methoxyphenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
N-tert-butyl-2-{[1-(4-methoxyphenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-7482 |
| Compound Name: | N-tert-butyl-2-{[1-(4-methoxyphenyl)-4-methyl-3-(pyrrolidine-1-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 557.63 |
| Molecular Formula: | C26 H31 N5 O7 S |
| Salt: | not_available |
| Smiles: | Cc1c(C(N2CCCC2)=O)nn(c2ccc(cc2)OC)c1Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.2012 |
| logD: | 4.2009 |
| logSw: | -4.3789 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.207 |
| InChI Key: | DROOWZHJSVVEFS-UHFFFAOYSA-N |