N-(3-chloro-4-methoxyphenyl)-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-(3-chloro-4-methoxyphenyl)-2-[rel-(1aR,7bR)-2-oxo-1a-(phenoxymethyl)-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
N-(3-chloro-4-methoxyphenyl)-2-[rel-(1aR,7bR)-2-oxo-1a-(phenoxymethyl)-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide
Compound characteristics
| Compound ID: | SC76-0578 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[rel-(1aR,7bR)-2-oxo-1a-(phenoxymethyl)-1,1a,2,7b-tetrahydro-3H-cyclopropa[c]quinolin-3-yl]acetamide |
| Molecular Weight: | 462.93 |
| Molecular Formula: | C26 H23 Cl N2 O4 |
| Smiles: | [H][C@]12C[C@]2(COc2ccccc2)C(N(CC(Nc2ccc(c(c2)[Cl])OC)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.8744 |
| logD: | 4.8739 |
| logSw: | -4.9022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.6 |
| InChI Key: | PDIAETZSHWJJNL-RXFWQSSRSA-N |