{4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}(furan-2-yl)methanone
Chemical Structure Depiction of
{4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}(furan-2-yl)methanone
{4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}(furan-2-yl)methanone
Compound characteristics
| Compound ID: | G636-2523 |
| Compound Name: | {4-[4-(azepane-1-sulfonyl)-1-methyl-1H-pyrrole-2-carbonyl]piperazin-1-yl}(furan-2-yl)methanone |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C21 H28 N4 O5 S |
| Smiles: | Cn1cc(cc1C(N1CCN(CC1)C(c1ccco1)=O)=O)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2715 |
| logD: | 1.2715 |
| logSw: | -2.1707 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.273 |
| InChI Key: | OEPOBQOARUPVBR-UHFFFAOYSA-N |