N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-[rel-(1aR,7bR)-2-oxo-1a-(phenoxymethyl)-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
Chemical Structure Depiction of
N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-[rel-(1aR,7bR)-2-oxo-1a-(phenoxymethyl)-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-[rel-(1aR,7bR)-2-oxo-1a-(phenoxymethyl)-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
Compound characteristics
| Compound ID: | SC76-0547 |
| Compound Name: | N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-N-ethyl-2-[rel-(1aR,7bR)-2-oxo-1a-(phenoxymethyl)-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C27 H30 N4 O3 |
| Smiles: | [H][C@]12C[C@]2(COc2ccccc2)C(N(CC(N(CC)Cc2cnn(C)c2C)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.89 |
| logD: | 2.89 |
| logSw: | -3.88 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 75.76 |
| InChI Key: | FRNCQKJLLMKVNL-WNCULLNHSA-N |