4-bromo-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-bromo-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
4-bromo-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V030-2802 |
| Compound Name: | 4-bromo-N-(4-{[4-(4-methylanilino)-2,5-dioxo-1-(propan-2-yl)-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 550.47 |
| Molecular Formula: | C27 H24 Br N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)N1C(C(=C(C1=O)Sc1ccc(cc1)NC(c1ccc(cc1)[Br])=O)Nc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0343 |
| logD: | 6.0327 |
| logSw: | -5.5063 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.686 |
| InChI Key: | UVTCIXYLBKHSAL-UHFFFAOYSA-N |