N-(4-{[4-anilino-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methylbenzamide
Chemical Structure Depiction of
N-(4-{[4-anilino-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methylbenzamide
N-(4-{[4-anilino-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methylbenzamide
Compound characteristics
| Compound ID: | V026-5498 |
| Compound Name: | N-(4-{[4-anilino-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methylbenzamide |
| Molecular Weight: | 501.6 |
| Molecular Formula: | C28 H27 N3 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)C(Nc1ccc(cc1)SC1=C(C(N(CCCOC)C1=O)=O)Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5404 |
| logD: | 4.5394 |
| logSw: | -4.1909 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.286 |
| InChI Key: | DEVOZXATKJJULV-UHFFFAOYSA-N |