N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-{[4-(4-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea
Chemical Structure Depiction of
N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-{[4-(4-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea
N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-{[4-(4-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea
Compound characteristics
| Compound ID: | V030-0758 |
| Compound Name: | N-[3,5-bis(trifluoromethyl)phenyl]-N'-(3-{[4-(4-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea |
| Molecular Weight: | 670.63 |
| Molecular Formula: | C33 H24 F6 N4 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(C)cc1)=O)Sc1cccc(c1)NC(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 8.7549 |
| logD: | 8.7425 |
| logSw: | -5.7614 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.294 |
| InChI Key: | DHPGEBMHGSEKNL-UHFFFAOYSA-N |