6-bromo-3-[4-(2-fluorophenyl)piperazine-1-carbonyl]-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[4-(2-fluorophenyl)piperazine-1-carbonyl]-8-methoxy-2H-1-benzopyran-2-one
6-bromo-3-[4-(2-fluorophenyl)piperazine-1-carbonyl]-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | 8014-1137 |
Compound Name: | 6-bromo-3-[4-(2-fluorophenyl)piperazine-1-carbonyl]-8-methoxy-2H-1-benzopyran-2-one |
Molecular Weight: | 461.29 |
Molecular Formula: | C21 H18 Br F N2 O4 |
Smiles: | COc1cc(cc2C=C(C(N3CCN(CC3)c3ccccc3F)=O)C(=O)Oc12)[Br] |
Stereo: | ACHIRAL |
logP: | 3.7965 |
logD: | 3.7965 |
logSw: | -4.1393 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.083 |
InChI Key: | VZGUWFKRPVIKFE-UHFFFAOYSA-N |