N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide
N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | V029-5613 |
| Compound Name: | N-(4-{[1-(2,4-dimethoxyphenyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 655.73 |
| Molecular Formula: | C35 H33 N3 O8 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(N(C1=O)c1ccc(cc1OC)OC)=O)Sc1ccc(cc1)NC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5886 |
| logD: | 5.5886 |
| logSw: | -5.4927 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.934 |
| InChI Key: | NYSXEVXPPDZWAG-UHFFFAOYSA-N |