4-bromo-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Chemical Structure Depiction of
4-bromo-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
4-bromo-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
Compound characteristics
| Compound ID: | V028-3920 |
| Compound Name: | 4-bromo-N-(4-{[4-(2-methoxy-5-methylanilino)-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide |
| Molecular Weight: | 610.53 |
| Molecular Formula: | C29 H28 Br N3 O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(c1)NC1=C(C(N(CCCOC)C1=O)=O)Sc1ccc(cc1)NC(c1ccc(cc1)[Br])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.3029 |
| logD: | 5.2857 |
| logSw: | -5.1512 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.219 |
| InChI Key: | YZNCTQYZOGLNFV-UHFFFAOYSA-N |