4-chloro-N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide
4-chloro-N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V026-6784 |
| Compound Name: | 4-chloro-N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzene-1-sulfonamide |
| Molecular Weight: | 626.11 |
| Molecular Formula: | C29 H24 Cl N3 O7 S2 |
| Salt: | not_available |
| Smiles: | COc1ccc(c(c1)OC)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1ccc(cc1)NS(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5785 |
| logD: | 5.4842 |
| logSw: | -5.8974 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.478 |
| InChI Key: | MWRGJSJGRZTEAM-UHFFFAOYSA-N |