4-fluoro-N-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-fluoro-N-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide
4-fluoro-N-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-0981 |
| Compound Name: | 4-fluoro-N-[3-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide |
| Molecular Weight: | 567.7 |
| Molecular Formula: | C29 H30 F N3 O4 S2 |
| Salt: | not_available |
| Smiles: | CC(C)CN1C(C(=C(C1=O)Sc1cccc(c1)NS(c1ccc(cc1)F)(=O)=O)Nc1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.526 |
| logD: | 6.4672 |
| logSw: | -5.6341 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.524 |
| InChI Key: | QVUYOABGAATCLF-UHFFFAOYSA-N |