N-[3-({4-(2,4-dimethoxyanilino)-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-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide
N-[3-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide
Compound characteristics
| Compound ID: | V030-6885 |
| Compound Name: | N-[3-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-fluorobenzamide |
| Molecular Weight: | 573.6 |
| Molecular Formula: | C30 H24 F N3 O6 S |
| Salt: | not_available |
| Smiles: | COc1ccc(c(c1)OC)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1cccc(c1)NC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9584 |
| logD: | 4.9436 |
| logSw: | -4.6071 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.919 |
| InChI Key: | WDEYXITWTDFAJI-UHFFFAOYSA-N |