3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6-methoxy-2H-1-benzopyran-2-one
3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | 8013-2265 |
Compound Name: | 3-[4-(3-chlorophenyl)piperazine-1-carbonyl]-6-methoxy-2H-1-benzopyran-2-one |
Molecular Weight: | 398.84 |
Molecular Formula: | C21 H19 Cl N2 O4 |
Smiles: | COc1ccc2c(C=C(C(N3CCN(CC3)c3cccc(c3)[Cl])=O)C(=O)O2)c1 |
Stereo: | ACHIRAL |
logP: | 3.3114 |
logD: | 3.3114 |
logSw: | -3.7725 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 48.612 |
InChI Key: | AQHSIMCNNBXUGV-UHFFFAOYSA-N |