3-methoxy-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
3-methoxy-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
3-methoxy-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V006-4594 |
| Compound Name: | 3-methoxy-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 579.68 |
| Molecular Formula: | C33 H29 N3 O5 S |
| Smiles: | Cc1ccc(cc1)N1C(C(=C(C1=O)Sc1ccc(cc1)NC(c1cccc(c1)OC)=O)Nc1cc(C)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8939 |
| logD: | 5.8938 |
| logSw: | -5.506 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.559 |
| InChI Key: | XKQSCVGVNQPDGE-UHFFFAOYSA-N |