N-(2,6-dimethylphenyl)-N'-(3-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-N'-(3-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea
N-(2,6-dimethylphenyl)-N'-(3-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea
Compound characteristics
| Compound ID: | V026-6542 |
| Compound Name: | N-(2,6-dimethylphenyl)-N'-(3-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)urea |
| Molecular Weight: | 592.72 |
| Molecular Formula: | C34 H32 N4 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)N1C(C(=C(C1=O)Sc1cccc(c1)NC(Nc1c(C)cccc1C)=O)Nc1cc(C)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5259 |
| logD: | 6.5259 |
| logSw: | -5.6138 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.831 |
| InChI Key: | HMRLEBMCZHEBIX-UHFFFAOYSA-N |