ethyl 1-(4-bromophenyl)-4-[(4-chlorophenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-bromophenyl)-4-[(4-chlorophenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
ethyl 1-(4-bromophenyl)-4-[(4-chlorophenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
Compound ID: | 4031-0100 |
Compound Name: | ethyl 1-(4-bromophenyl)-4-[(4-chlorophenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
Molecular Weight: | 446.73 |
Molecular Formula: | C21 H17 Br Cl N O3 |
Smiles: | CCOC(C1/C(=C/c2ccc(cc2)[Cl])C(N(C=1C)c1ccc(cc1)[Br])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.371 |
logD: | 5.371 |
logSw: | -6.1573 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 36.079 |
InChI Key: | GBKOOPKVYYCLMP-UHFFFAOYSA-N |