N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide
N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide
Compound characteristics
Compound ID: | V027-4042 |
Compound Name: | N-[4-({4-(3,4-dimethylanilino)-1-[(furan-2-yl)methyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]furan-2-carboxamide |
Molecular Weight: | 513.57 |
Molecular Formula: | C28 H23 N3 O5 S |
Salt: | not_available |
Smiles: | Cc1ccc(cc1C)NC1=C(C(N(Cc2ccco2)C1=O)=O)Sc1ccc(cc1)NC(c1ccco1)=O |
Stereo: | ACHIRAL |
logP: | 5.2299 |
logD: | 5.2296 |
logSw: | -4.9618 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 78.021 |
InChI Key: | HVDCQRGYKKCCQG-UHFFFAOYSA-N |