{4-[4-(azepane-1-carbonyl)piperidine-1-sulfonyl]-1-methyl-1H-pyrrol-2-yl}(4-methylpiperidin-1-yl)methanone
Chemical Structure Depiction of
{4-[4-(azepane-1-carbonyl)piperidine-1-sulfonyl]-1-methyl-1H-pyrrol-2-yl}(4-methylpiperidin-1-yl)methanone
{4-[4-(azepane-1-carbonyl)piperidine-1-sulfonyl]-1-methyl-1H-pyrrol-2-yl}(4-methylpiperidin-1-yl)methanone
Compound characteristics
| Compound ID: | L230-0847 |
| Compound Name: | {4-[4-(azepane-1-carbonyl)piperidine-1-sulfonyl]-1-methyl-1H-pyrrol-2-yl}(4-methylpiperidin-1-yl)methanone |
| Molecular Weight: | 478.65 |
| Molecular Formula: | C24 H38 N4 O4 S |
| Smiles: | CC1CCN(CC1)C(c1cc(cn1C)S(N1CCC(CC1)C(N1CCCCCC1)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4548 |
| logD: | 2.4548 |
| logSw: | -2.5528 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.887 |
| InChI Key: | KIUAGIDGBFDJDI-UHFFFAOYSA-N |