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]-2,4-dimethoxybenzamide
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]-2,4-dimethoxybenzamide
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]-2,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | V029-9062 |
| 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]-2,4-dimethoxybenzamide |
| Molecular Weight: | 597.69 |
| Molecular Formula: | C33 H31 N3 O6 S |
| Salt: | not_available |
| Smiles: | CC(C)c1ccc(cc1)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1cccc(c1)NC(c1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2235 |
| logD: | 6.2226 |
| logSw: | -5.5125 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.617 |
| InChI Key: | WEKQIEBAEJYQED-UHFFFAOYSA-N |