N-(4-{[1-(3,4-dimethylphenyl)-4-(4-methoxyanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dimethoxybenzamide
Chemical Structure Depiction of
N-(4-{[1-(3,4-dimethylphenyl)-4-(4-methoxyanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dimethoxybenzamide
N-(4-{[1-(3,4-dimethylphenyl)-4-(4-methoxyanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | V029-7929 |
| Compound Name: | N-(4-{[1-(3,4-dimethylphenyl)-4-(4-methoxyanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-2,4-dimethoxybenzamide |
| Molecular Weight: | 609.7 |
| Molecular Formula: | C34 H31 N3 O6 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)N1C(C(=C(C1=O)Sc1ccc(cc1)NC(c1ccc(cc1OC)OC)=O)Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3875 |
| logD: | 6.386 |
| logSw: | -5.6157 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.8 |
| InChI Key: | FYGPLJRVKXUQHP-UHFFFAOYSA-N |