N-(3-{[4-(4-bromoanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methoxybenzamide
Chemical Structure Depiction of
N-(3-{[4-(4-bromoanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methoxybenzamide
N-(3-{[4-(4-bromoanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | V025-8171 |
| Compound Name: | N-(3-{[4-(4-bromoanilino)-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)-4-methoxybenzamide |
| Molecular Weight: | 630.52 |
| Molecular Formula: | C31 H24 Br N3 O5 S |
| Smiles: | COc1ccc(cc1)C(Nc1cccc(c1)SC1=C(C(N(C1=O)c1ccc(cc1)OC)=O)Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.9375 |
| logD: | 5.9373 |
| logSw: | -5.5775 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.17 |
| InChI Key: | OTEAZNQGMKECJW-UHFFFAOYSA-N |