rel-(1aR,7bR)-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-1a-(phenoxymethyl)-1,1a,3,7b-tetrahydro-2H-cyclopropa[c]quinolin-2-one
Chemical Structure Depiction of
rel-(1aR,7bR)-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-1a-(phenoxymethyl)-1,1a,3,7b-tetrahydro-2H-cyclopropa[c]quinolin-2-one
rel-(1aR,7bR)-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-1a-(phenoxymethyl)-1,1a,3,7b-tetrahydro-2H-cyclopropa[c]quinolin-2-one
Compound characteristics
Compound ID: | SC76-0537 |
Compound Name: | rel-(1aR,7bR)-3-[2-oxo-2-(4-propylpiperazin-1-yl)ethyl]-1a-(phenoxymethyl)-1,1a,3,7b-tetrahydro-2H-cyclopropa[c]quinolin-2-one |
Molecular Weight: | 433.55 |
Molecular Formula: | C26 H31 N3 O3 |
Smiles: | [H][C@]12C[C@]2(COc2ccccc2)C(N(CC(N2CCN(CCC)CC2)=O)c2ccccc12)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 2.9225 |
logD: | 2.74 |
logSw: | -3.1957 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 43.003 |
InChI Key: | HYVOHPCDADQHOR-BKMJKUGQSA-N |