3-methyl-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)butanamide
Chemical Structure Depiction of
3-methyl-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)butanamide
3-methyl-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)butanamide
Compound characteristics
| Compound ID: | V030-6965 |
| Compound Name: | 3-methyl-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)butanamide |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C25 H29 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(cc1)SC1=C(C(N(C(C)C)C1=O)=O)Nc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9986 |
| logD: | 4.9972 |
| logSw: | -4.5411 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.744 |
| InChI Key: | UKPHWXAOXBVTKH-UHFFFAOYSA-N |