2-chloro-N-[3-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
Chemical Structure Depiction of
2-chloro-N-[3-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
2-chloro-N-[3-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
Compound characteristics
| Compound ID: | V030-1998 |
| Compound Name: | 2-chloro-N-[3-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide |
| Molecular Weight: | 590.05 |
| Molecular Formula: | C30 H24 Cl N3 O6 S |
| Salt: | not_available |
| Smiles: | COc1ccc(c(c1)OC)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1cccc(c1)NC(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3845 |
| logD: | 5.3696 |
| logSw: | -5.7868 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.919 |
| InChI Key: | CXBKVHNCRGOATN-UHFFFAOYSA-N |