2-{[1,4-dimethyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
2-{[1,4-dimethyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide
2-{[1,4-dimethyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V025-8223 |
| Compound Name: | 2-{[1,4-dimethyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-N-(2-methylpropyl)-5-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 481.53 |
| Molecular Formula: | C20 H27 N5 O7 S |
| Salt: | not_available |
| Smiles: | CC(C)CNS(c1cc(ccc1Oc1c(C)c(C(N2CCOCC2)=O)nn1C)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8288 |
| logD: | 1.8287 |
| logSw: | -2.6956 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 121.59 |
| InChI Key: | APNFPYREHSYCKV-UHFFFAOYSA-N |