5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-N-benzyl-1,2-dimethyl-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-N-benzyl-1,2-dimethyl-1H-pyrrole-3-sulfonamide
5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-N-benzyl-1,2-dimethyl-1H-pyrrole-3-sulfonamide
Compound characteristics
Compound ID: | L507-1782 |
Compound Name: | 5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-N-benzyl-1,2-dimethyl-1H-pyrrole-3-sulfonamide |
Molecular Weight: | 486.65 |
Molecular Formula: | C24 H30 N4 O3 S2 |
Smiles: | Cc1c(C(N2CCCCCC2)=O)sc(c2cc(c(C)n2C)S(NCc2ccccc2)(=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 4.1781 |
logD: | 4.1768 |
logSw: | -4.1444 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.319 |
InChI Key: | IIKFPKIZCWYQKE-UHFFFAOYSA-N |