N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-(trifluoromethyl)benzene-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]-3-(trifluoromethyl)benzene-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]-3-(trifluoromethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-0972 |
| 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]-3-(trifluoromethyl)benzene-1-sulfonamide |
| Molecular Weight: | 627.66 |
| Molecular Formula: | C30 H24 F3 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1ccc(cc1)NS(c1cccc(c1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6295 |
| logD: | 6.5912 |
| logSw: | -5.7175 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.001 |
| InChI Key: | VGGIOSIMFHRUBW-UHFFFAOYSA-N |