4-tert-butyl-N-(3-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(3-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
4-tert-butyl-N-(3-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V028-3393 |
| Compound Name: | 4-tert-butyl-N-(3-{[1-(3-methoxypropyl)-4-(4-methylanilino)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 557.71 |
| Molecular Formula: | C32 H35 N3 O4 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)NC1=C(C(N(CCCOC)C1=O)=O)Sc1cccc(c1)NC(c1ccc(cc1)C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4174 |
| logD: | 6.416 |
| logSw: | -5.5093 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.286 |
| InChI Key: | REMGXNNRZDJQCQ-UHFFFAOYSA-N |