5-chloro-N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
5-chloro-N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-methoxybenzene-1-sulfonamide
5-chloro-N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-methoxybenzene-1-sulfonamide
Compound characteristics
Compound ID: | G529-0421 |
Compound Name: | 5-chloro-N-({1-[(2,5-dimethylphenyl)methyl]-1H-pyrrol-2-yl}methyl)-2-methoxybenzene-1-sulfonamide |
Molecular Weight: | 418.94 |
Molecular Formula: | C21 H23 Cl N2 O3 S |
Smiles: | Cc1ccc(C)c(Cn2cccc2CNS(c2cc(ccc2OC)[Cl])(=O)=O)c1 |
Stereo: | ACHIRAL |
logP: | 5.1298 |
logD: | 5.1289 |
logSw: | -5.5142 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.697 |
InChI Key: | ZBSIWNXCQVVWIT-UHFFFAOYSA-N |