4-chloro-N-(3-{[1-(4-fluorophenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(3-{[1-(4-fluorophenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
4-chloro-N-(3-{[1-(4-fluorophenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
Compound ID: | V030-4842 |
Compound Name: | 4-chloro-N-(3-{[1-(4-fluorophenyl)-4-(2-methoxy-5-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
Molecular Weight: | 588.06 |
Molecular Formula: | C31 H23 Cl F N3 O4 S |
Salt: | not_available |
Smiles: | Cc1ccc(c(c1)NC1=C(C(N(C1=O)c1ccc(cc1)F)=O)Sc1cccc(c1)NC(c1ccc(cc1)[Cl])=O)OC |
Stereo: | ACHIRAL |
logP: | 5.9229 |
logD: | 5.9221 |
logSw: | -6.2053 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.015 |
InChI Key: | IFJQHCNWUPVAFS-UHFFFAOYSA-N |