4-fluoro-N-(3-{[4-(4-methylanilino)-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-fluoro-N-(3-{[4-(4-methylanilino)-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
4-fluoro-N-(3-{[4-(4-methylanilino)-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | V028-3473 |
Compound Name: | 4-fluoro-N-(3-{[4-(4-methylanilino)-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide |
Molecular Weight: | 559.64 |
Molecular Formula: | C29 H22 F N3 O4 S2 |
Salt: | not_available |
Smiles: | Cc1ccc(cc1)NC1=C(C(N(C1=O)c1ccccc1)=O)Sc1cccc(c1)NS(c1ccc(cc1)F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.3818 |
logD: | 5.323 |
logSw: | -5.401 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.641 |
InChI Key: | POQGFUROLZDOTO-UHFFFAOYSA-N |