N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methoxybenzamide
Chemical Structure Depiction of
N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methoxybenzamide
N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methoxybenzamide
Compound characteristics
| Compound ID: | V029-8502 |
| Compound Name: | N-[3-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methoxybenzamide |
| Molecular Weight: | 604.48 |
| Molecular Formula: | C29 H22 Br N3 O5 S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)C(Nc1cccc(c1)SC1=C(C(N(Cc2ccco2)C1=O)=O)Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7568 |
| logD: | 5.7411 |
| logSw: | -5.4739 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.987 |
| InChI Key: | OYPINZMKOFTAFR-UHFFFAOYSA-N |