4-tert-butyl-N-(3-{[4-(2,4-dimethoxyanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-tert-butyl-N-(3-{[4-(2,4-dimethoxyanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
4-tert-butyl-N-(3-{[4-(2,4-dimethoxyanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-5977 |
| Compound Name: | 4-tert-butyl-N-(3-{[4-(2,4-dimethoxyanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzene-1-sulfonamide |
| Molecular Weight: | 639.79 |
| Molecular Formula: | C32 H37 N3 O7 S2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)c1ccc(cc1)S(Nc1cccc(c1)SC1=C(C(N(CCCOC)C1=O)=O)Nc1ccc(cc1OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9747 |
| logD: | 5.9216 |
| logSw: | -5.3757 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.321 |
| InChI Key: | FFURVAIOIJIIAN-UHFFFAOYSA-N |