N-(3-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(3-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide
N-(3-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V029-8535 |
| Compound Name: | N-(3-{[4-(4-fluoroanilino)-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)thiophene-2-carboxamide |
| Molecular Weight: | 533.57 |
| Molecular Formula: | C27 H17 F2 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | c1cc(cc(c1)SC1=C(C(N(C1=O)c1ccc(cc1)F)=O)Nc1ccc(cc1)F)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1095 |
| logD: | 5.1094 |
| logSw: | -5.3604 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.101 |
| InChI Key: | POHLSGRHAYDRKE-UHFFFAOYSA-N |