N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide
N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V027-4115 |
| Compound Name: | N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 573.69 |
| Molecular Formula: | C30 H27 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(Nc1ccc(cc1)SC1=C(C(N(Cc2ccco2)C1=O)=O)Nc1ccc(C)c(C)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.326 |
| logD: | 6.2877 |
| logSw: | -5.2998 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.001 |
| InChI Key: | UDDGZKLOCBZCSI-UHFFFAOYSA-N |