N-(3-{[1-(2,4-dimethoxyphenyl)-4-(4-fluoroanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)furan-2-carboxamide
Chemical Structure Depiction of
N-(3-{[1-(2,4-dimethoxyphenyl)-4-(4-fluoroanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)furan-2-carboxamide
N-(3-{[1-(2,4-dimethoxyphenyl)-4-(4-fluoroanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)furan-2-carboxamide
Compound characteristics
| Compound ID: | V030-0303 |
| Compound Name: | N-(3-{[1-(2,4-dimethoxyphenyl)-4-(4-fluoroanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)furan-2-carboxamide |
| Molecular Weight: | 559.57 |
| Molecular Formula: | C29 H22 F N3 O6 S |
| Salt: | not_available |
| Smiles: | COc1ccc(c(c1)OC)N1C(C(=C(C1=O)Sc1cccc(c1)NC(c1ccco1)=O)Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5768 |
| logD: | 4.5768 |
| logSw: | -4.4895 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.534 |
| InChI Key: | HIRPAYVPXBOLBE-UHFFFAOYSA-N |