2-[6-(morpholin-4-yl)-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl]ethyl 3-chlorobenzoate
Chemical Structure Depiction of
2-[6-(morpholin-4-yl)-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl]ethyl 3-chlorobenzoate
2-[6-(morpholin-4-yl)-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl]ethyl 3-chlorobenzoate
Compound characteristics
Compound ID: | 1186-0491 |
Compound Name: | 2-[6-(morpholin-4-yl)-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl]ethyl 3-chlorobenzoate |
Molecular Weight: | 464.9 |
Molecular Formula: | C25 H21 Cl N2 O5 |
Smiles: | C1COCCN1c1ccc2C(N(CCOC(c3cccc(c3)[Cl])=O)C(c3cccc1c23)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.6477 |
logD: | 4.6477 |
logSw: | -4.96 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 60.94 |
InChI Key: | LNYIHZUWGGYYAE-UHFFFAOYSA-N |