4-chloro-N-(4-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-(4-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
4-chloro-N-(4-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V031-2587 |
| Compound Name: | 4-chloro-N-(4-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide |
| Molecular Weight: | 598.05 |
| Molecular Formula: | C28 H18 Cl F2 N3 O4 S2 |
| Salt: | not_available |
| Smiles: | c1cc(ccc1NC1=C(C(N(C1=O)c1ccc(cc1)F)=O)Sc1ccc(cc1)NS(c1ccc(cc1)[Cl])(=O)=O)F |
| Stereo: | ACHIRAL |
| logP: | 5.8461 |
| logD: | 5.7518 |
| logSw: | -6.1659 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.641 |
| InChI Key: | XCEJOJPTRXGMTK-UHFFFAOYSA-N |