N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-chlorobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-chlorobenzene-1-sulfonamide
N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-chlorobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V031-2539 |
| Compound Name: | N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-chlorobenzene-1-sulfonamide |
| Molecular Weight: | 644.95 |
| Molecular Formula: | C27 H19 Br Cl N3 O5 S2 |
| Salt: | not_available |
| Smiles: | C(c1ccco1)N1C(C(=C(C1=O)Sc1ccc(cc1)NS(c1ccc(cc1)[Cl])(=O)=O)Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.3438 |
| logD: | 6.2495 |
| logSw: | -6.3161 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.001 |
| InChI Key: | KXBDFIBLISWXOC-UHFFFAOYSA-N |