N-(4-{[4-(3,4-dimethylanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-(4-{[4-(3,4-dimethylanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide
N-(4-{[4-(3,4-dimethylanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | V029-9122 |
| Compound Name: | N-(4-{[4-(3,4-dimethylanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 639.73 |
| Molecular Formula: | C35 H33 N3 O7 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)NC1=C(C(N(C1=O)c1ccc(cc1)OC)=O)Sc1ccc(cc1)NC(c1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9986 |
| logD: | 5.9986 |
| logSw: | -5.5179 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.604 |
| InChI Key: | LDSUNXSBXYJFDJ-UHFFFAOYSA-N |