5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-(3-methylpyridin-2-yl)-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-(3-methylpyridin-2-yl)-1H-pyrrole-3-sulfonamide
5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-(3-methylpyridin-2-yl)-1H-pyrrole-3-sulfonamide
Compound characteristics
Compound ID: | L507-1592 |
Compound Name: | 5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-(3-methylpyridin-2-yl)-1H-pyrrole-3-sulfonamide |
Molecular Weight: | 487.64 |
Molecular Formula: | C23 H29 N5 O3 S2 |
Smiles: | Cc1cccnc1NS(c1cc(c2nc(C)c(C(N3CCCCCC3)=O)s2)n(C)c1C)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.7874 |
logD: | 3.3939 |
logSw: | -3.736 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.898 |
InChI Key: | KJPHMDSDHYKKOH-UHFFFAOYSA-N |