5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]-1H-pyrrole-3-sulfonamide
Chemical Structure Depiction of
5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]-1H-pyrrole-3-sulfonamide
5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]-1H-pyrrole-3-sulfonamide
Compound characteristics
Compound ID: | L507-1750 |
Compound Name: | 5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]-1H-pyrrole-3-sulfonamide |
Molecular Weight: | 490.64 |
Molecular Formula: | C23 H30 N4 O4 S2 |
Smiles: | Cc1c(C(N2CCCCCC2)=O)sc(c2cc(c(C)n2C)S(NCc2ccc(C)o2)(=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 4.0072 |
logD: | 4.0063 |
logSw: | -3.9712 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.582 |
InChI Key: | MISNZPFYGSHCJJ-UHFFFAOYSA-N |