4-butoxy-N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-butoxy-N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
4-butoxy-N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V026-6711 |
| Compound Name: | 4-butoxy-N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 559.68 |
| Molecular Formula: | C31 H33 N3 O5 S |
| Salt: | not_available |
| Smiles: | CCCCOc1ccc(cc1)C(Nc1ccc(cc1)SC1=C(C(N(C(C)C)C1=O)=O)Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1917 |
| logD: | 6.1896 |
| logSw: | -5.4107 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.648 |
| InChI Key: | KWOWCDXHSATVRH-UHFFFAOYSA-N |