N-benzyl-2-[rel-(1aR,7bR)-1a-(hydroxymethyl)-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[rel-(1aR,7bR)-1a-(hydroxymethyl)-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
N-benzyl-2-[rel-(1aR,7bR)-1a-(hydroxymethyl)-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
Compound characteristics
| Compound ID: | SC76-0079 |
| Compound Name: | N-benzyl-2-[rel-(1aR,7bR)-1a-(hydroxymethyl)-2-oxo-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C20 H20 N2 O3 |
| Smiles: | [H][C@]12C[C@]2(CO)C(N(CC(NCc2ccccc2)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7703 |
| logD: | 1.7703 |
| logSw: | -2.0526 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.179 |
| InChI Key: | YWRWOXGMJYJZSY-OXJNMPFZSA-N |