3-methyl-N-[4-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]butanamide
Chemical Structure Depiction of
3-methyl-N-[4-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]butanamide
3-methyl-N-[4-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]butanamide
Compound characteristics
| Compound ID: | V026-7519 |
| Compound Name: | 3-methyl-N-[4-({1-(2-methylpropyl)-2,5-dioxo-4-[4-(propan-2-yl)anilino]-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]butanamide |
| Molecular Weight: | 493.67 |
| Molecular Formula: | C28 H35 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(cc1)SC1=C(C(N(CC(C)C)C1=O)=O)Nc1ccc(cc1)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4922 |
| logD: | 6.4909 |
| logSw: | -5.6716 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.024 |
| InChI Key: | XSSBORVIURUGPE-UHFFFAOYSA-N |