N-tert-butyl-2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-tert-butyl-2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
N-tert-butyl-2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide
Compound characteristics
Compound ID: | V030-7324 |
Compound Name: | N-tert-butyl-2-{[1-(2,5-dimethylphenyl)-4-methyl-3-(morpholine-4-carbonyl)-1H-pyrazol-5-yl]oxy}-5-nitrobenzene-1-sulfonamide |
Molecular Weight: | 571.65 |
Molecular Formula: | C27 H33 N5 O7 S |
Salt: | not_available |
Smiles: | Cc1ccc(C)c(c1)n1c(c(C)c(C(N2CCOCC2)=O)n1)Oc1ccc(cc1S(NC(C)(C)C)(=O)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.3061 |
logD: | 4.3058 |
logSw: | -4.3444 |
Hydrogen bond acceptors count: | 14 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 119.905 |
InChI Key: | FNYINLPQWAHWNK-UHFFFAOYSA-N |