2-chloro-N-(3-{[1-(4-fluorophenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
2-chloro-N-(3-{[1-(4-fluorophenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
2-chloro-N-(3-{[1-(4-fluorophenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V027-5274 |
| Compound Name: | 2-chloro-N-(3-{[1-(4-fluorophenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 558.03 |
| Molecular Formula: | C30 H21 Cl F N3 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(cc1)F)=O)Sc1cccc(c1)NC(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.0464 |
| logD: | 6.0456 |
| logSw: | -5.9424 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.083 |
| InChI Key: | KETQDWCHBYPZAG-UHFFFAOYSA-N |