N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)cyclopentanecarboxamide
Chemical Structure Depiction of
N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)cyclopentanecarboxamide
N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)cyclopentanecarboxamide
Compound characteristics
| Compound ID: | V026-5512 |
| Compound Name: | N-(4-{[4-(4-methoxyanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)cyclopentanecarboxamide |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C26 H29 N3 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)N1C(C(=C(C1=O)Sc1ccc(cc1)NC(C1CCCC1)=O)Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5288 |
| logD: | 4.5267 |
| logSw: | -4.1916 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.788 |
| InChI Key: | BVGYIBBZEOAQGF-UHFFFAOYSA-N |