4-fluoro-N-(3-{[4-(4-methoxyanilino)-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-methoxyanilino)-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
4-fluoro-N-(3-{[4-(4-methoxyanilino)-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V031-2569 |
| Compound Name: | 4-fluoro-N-(3-{[4-(4-methoxyanilino)-2,5-dioxo-1-phenyl-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide |
| Molecular Weight: | 575.64 |
| Molecular Formula: | C29 H22 F N3 O5 S2 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)NC1=C(C(N(C1=O)c1ccccc1)=O)Sc1cccc(c1)NS(c1ccc(cc1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9408 |
| logD: | 4.882 |
| logSw: | -4.682 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.185 |
| InChI Key: | ZMAYTQKVCFKPML-UHFFFAOYSA-N |