N,4-dimethyl-1-(4-methylphenyl)-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-N-propyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N,4-dimethyl-1-(4-methylphenyl)-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-N-propyl-1H-pyrazole-3-carboxamide
N,4-dimethyl-1-(4-methylphenyl)-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-N-propyl-1H-pyrazole-3-carboxamide
Compound characteristics
Compound ID: | V003-4145 |
Compound Name: | N,4-dimethyl-1-(4-methylphenyl)-5-[2-(morpholine-4-sulfonyl)-4-nitrophenoxy]-N-propyl-1H-pyrazole-3-carboxamide |
Molecular Weight: | 557.63 |
Molecular Formula: | C26 H31 N5 O7 S |
Smiles: | CCCN(C)C(c1c(C)c(n(c2ccc(C)cc2)n1)Oc1ccc(cc1S(N1CCOCC1)(=O)=O)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7892 |
logD: | 3.7892 |
logSw: | -3.8002 |
Hydrogen bond acceptors count: | 14 |
Polar surface area: | 110.602 |
InChI Key: | QJHVEBIQVOKXHP-UHFFFAOYSA-N |