N-benzyl-1,2-dimethyl-5-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
N-benzyl-1,2-dimethyl-5-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
N-benzyl-1,2-dimethyl-5-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide
Compound characteristics
Compound ID: | L507-0603 |
Compound Name: | N-benzyl-1,2-dimethyl-5-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]-1H-pyrrole-3-sulfonamide |
Molecular Weight: | 472.63 |
Molecular Formula: | C23 H28 N4 O3 S2 |
Smiles: | Cc1c(C(N2CCCCC2)=O)sc(c2cc(c(C)n2C)S(NCc2ccccc2)(=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 3.6822 |
logD: | 3.6809 |
logSw: | -3.8592 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.988 |
InChI Key: | SMACHKQYYXOYIN-UHFFFAOYSA-N |