N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1-(6-phenylpyridazin-3-yl)-1H-pyrazole-4-sulfonamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1-(6-phenylpyridazin-3-yl)-1H-pyrazole-4-sulfonamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1-(6-phenylpyridazin-3-yl)-1H-pyrazole-4-sulfonamide
Compound characteristics
Compound ID: | M348-0099 |
Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,5-dimethyl-1-(6-phenylpyridazin-3-yl)-1H-pyrazole-4-sulfonamide |
Molecular Weight: | 463.51 |
Molecular Formula: | C23 H21 N5 O4 S |
Smiles: | Cc1c(c(C)n(c2ccc(c3ccccc3)nn2)n1)S(Nc1ccc2c(c1)OCCO2)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.3731 |
logD: | 2.2206 |
logSw: | -2.9095 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 92.064 |
InChI Key: | XKNIAPFTJJUAPJ-UHFFFAOYSA-N |