N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3-phenylpropanamide
N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | V031-2504 |
| Compound Name: | N-(4-{[4-anilino-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3-phenylpropanamide |
| Molecular Weight: | 537.61 |
| Molecular Formula: | C31 H24 F N3 O3 S |
| Salt: | not_available |
| Smiles: | C(Cc1ccccc1)C(Nc1ccc(cc1)SC1=C(C(N(C1=O)c1ccc(cc1)F)=O)Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4614 |
| logD: | 5.4614 |
| logSw: | -5.7502 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.869 |
| InChI Key: | BMSXVPMNWJQGLC-UHFFFAOYSA-N |