methyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
methyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
methyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 8007-7480 |
| Compound Name: | methyl 2-amino-4-(2H-1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 466.92 |
| Molecular Formula: | C25 H23 Cl N2 O5 |
| Smiles: | Cc1c(cccc1[Cl])N1C2CCCC(C=2C(C(=C1N)C(=O)OC)c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2179 |
| logD: | 4.2179 |
| logSw: | -4.614 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.309 |
| InChI Key: | SCDDABYMDBUZRK-NRFANRHFSA-N |