5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(oxolan-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-[(oxolan-2-yl)methyl]-1H-pyrrole-3-sulfonamide
5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(oxolan-2-yl)methyl]-1H-pyrrole-3-sulfonamide
Compound characteristics
| Compound ID: | L507-1685 |
| Compound Name: | 5-[5-(azepane-1-carbonyl)-4-methyl-1,3-thiazol-2-yl]-1,2-dimethyl-N-[(oxolan-2-yl)methyl]-1H-pyrrole-3-sulfonamide |
| Molecular Weight: | 480.65 |
| Molecular Formula: | C22 H32 N4 O4 S2 |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)sc(c2cc(c(C)n2C)S(NCC2CCCO2)(=O)=O)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8029 |
| logD: | 2.8027 |
| logSw: | -3.2431 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.974 |
| InChI Key: | QAPWCMMYIOAFAE-QGZVFWFLSA-N |