N-(2H-1,3-benzodioxol-5-yl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
N-(2H-1,3-benzodioxol-5-yl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide
Compound characteristics
Compound ID: | C071-0409 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]butanamide |
Molecular Weight: | 523.49 |
Molecular Formula: | C23 H20 F3 N3 O6 S |
Smiles: | COc1ccccc1c1cc(C(F)(F)F)nc(n1)S(CCCC(Nc1ccc2c(c1)OCO2)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4476 |
logD: | 3.4472 |
logSw: | -3.9712 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 94.748 |
InChI Key: | ZXUMEVJPOOFQHG-UHFFFAOYSA-N |