N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide
Chemical Structure Depiction of
N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide
N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V026-6748 |
| Compound Name: | N-[4-({4-(2,4-dimethoxyanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]cyclopentanecarboxamide |
| Molecular Weight: | 547.63 |
| Molecular Formula: | C29 H29 N3 O6 S |
| Salt: | not_available |
| Smiles: | COc1ccc(c(c1)OC)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1ccc(cc1)NC(C1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8079 |
| logD: | 4.7931 |
| logSw: | -4.5624 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.477 |
| InChI Key: | WHQVBSSDGVSLDI-UHFFFAOYSA-N |