N-[3-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[3-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide
N-[3-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V030-2837 |
| Compound Name: | N-[3-({1-[(furan-2-yl)methyl]-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 587.72 |
| Molecular Formula: | C31 H29 N3 O5 S2 |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1cccc(c1)NS(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5344 |
| logD: | 6.5111 |
| logSw: | -5.5559 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.001 |
| InChI Key: | VIWKSWLCVYNGRZ-UHFFFAOYSA-N |