N-(3-{[4-(4-methoxyanilino)-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide
Chemical Structure Depiction of
N-(3-{[4-(4-methoxyanilino)-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide
N-(3-{[4-(4-methoxyanilino)-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide
Compound characteristics
| Compound ID: | V031-2581 |
| Compound Name: | N-(3-{[4-(4-methoxyanilino)-1-(2-methoxy-5-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzenesulfonamide |
| Molecular Weight: | 601.7 |
| Molecular Formula: | C31 H27 N3 O6 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)N1C(C(=C(C1=O)Sc1cccc(c1)NS(c1ccccc1)(=O)=O)Nc1ccc(cc1)OC)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2363 |
| logD: | 5.213 |
| logSw: | -5.1006 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.514 |
| InChI Key: | HVGDDBAPXJASJW-UHFFFAOYSA-N |