N-[(4-methylphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide
N-[(4-methylphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide
Compound characteristics
Compound ID: | G554-0438 |
Compound Name: | N-[(4-methylphenyl)methyl]-3-(pyrrolidine-1-sulfonyl)-4-(pyrrolidin-1-yl)benzamide |
Molecular Weight: | 427.56 |
Molecular Formula: | C23 H29 N3 O3 S |
Smiles: | Cc1ccc(CNC(c2ccc(c(c2)S(N2CCCC2)(=O)=O)N2CCCC2)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 3.638 |
logD: | 3.6378 |
logSw: | -3.9045 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.246 |
InChI Key: | UIQBRVARTDTKPI-UHFFFAOYSA-N |