N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide
Chemical Structure Depiction of
N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide
N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | V029-8572 |
| Compound Name: | N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide |
| Molecular Weight: | 592.44 |
| Molecular Formula: | C28 H19 Br F N3 O4 S |
| Salt: | not_available |
| Smiles: | C(c1ccco1)N1C(C(=C(C1=O)Sc1cccc(c1)NC(c1ccc(cc1)F)=O)Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7237 |
| logD: | 5.708 |
| logSw: | -5.9038 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.443 |
| InChI Key: | FNESLJDTGNNEMH-UHFFFAOYSA-N |