N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2-chlorobenzamide
Chemical Structure Depiction of
N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2-chlorobenzamide
N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2-chlorobenzamide
Compound characteristics
| Compound ID: | V027-3827 |
| Compound Name: | N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2-chlorobenzamide |
| Molecular Weight: | 544 |
| Molecular Formula: | C29 H19 Cl F N3 O3 S |
| Salt: | not_available |
| Smiles: | c1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(cc1)F)=O)Sc1ccc(cc1)NC(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5405 |
| logD: | 5.5391 |
| logSw: | -5.8507 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.083 |
| InChI Key: | MVAFYXAKNIUHCO-UHFFFAOYSA-N |