N-(4-{[4-anilino-1-(2-methylpropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-bromobenzamide
Chemical Structure Depiction of
N-(4-{[4-anilino-1-(2-methylpropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-bromobenzamide
N-(4-{[4-anilino-1-(2-methylpropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-bromobenzamide
Compound characteristics
| Compound ID: | V029-8266 |
| Compound Name: | N-(4-{[4-anilino-1-(2-methylpropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-bromobenzamide |
| Molecular Weight: | 550.47 |
| Molecular Formula: | C27 H24 Br N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CN1C(C(=C(C1=O)Sc1ccc(cc1)NC(c1ccc(cc1)[Br])=O)Nc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9979 |
| logD: | 5.9966 |
| logSw: | -5.5922 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.965 |
| InChI Key: | RVPOUHKIIMWFSB-UHFFFAOYSA-N |