N-(3-{[4-anilino-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-fluorobenzamide
Chemical Structure Depiction of
N-(3-{[4-anilino-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-fluorobenzamide
N-(3-{[4-anilino-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | V030-2067 |
| Compound Name: | N-(3-{[4-anilino-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-fluorobenzamide |
| Molecular Weight: | 553.61 |
| Molecular Formula: | C31 H24 F N3 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)N1C(C(=C(C1=O)Sc1cccc(c1)NC(c1ccc(cc1)F)=O)Nc1ccccc1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.3642 |
| logD: | 5.3633 |
| logSw: | -5.4491 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.412 |
| InChI Key: | WLADVVAGJUNHGV-UHFFFAOYSA-N |