N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2-chlorobenzamide
N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | V027-4116 |
| Compound Name: | N-[4-({4-(4-bromoanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-2-chlorobenzamide |
| Molecular Weight: | 608.9 |
| Molecular Formula: | C28 H19 Br Cl N3 O4 S |
| Salt: | not_available |
| Smiles: | C(c1ccco1)N1C(C(=C(C1=O)Sc1ccc(cc1)NC(c1ccccc1[Cl])=O)Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.259 |
| logD: | 6.2433 |
| logSw: | -6.0328 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.443 |
| InChI Key: | MNQHYRZXJKTTLH-UHFFFAOYSA-N |