N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]butanamide
Chemical Structure Depiction of
N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]butanamide
N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]butanamide
Compound characteristics
Compound ID: | D715-2261 |
Compound Name: | N-[3-(4-methoxybenzene-1-sulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-yl]butanamide |
Molecular Weight: | 392.52 |
Molecular Formula: | C20 H28 N2 O4 S |
Smiles: | CCCC(Nc1c(c(C)c(C)n1C(C)C)S(c1ccc(cc1)OC)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.4868 |
logD: | 3.485 |
logSw: | -3.7844 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 63.149 |
InChI Key: | CUMMPTLPVSVYHN-UHFFFAOYSA-N |