butyl 4-(3-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
butyl 4-(3-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
butyl 4-(3-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 1630-1444 |
| Compound Name: | butyl 4-(3-iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 465.33 |
| Molecular Formula: | C21 H24 I N O3 |
| Smiles: | CCCCOC(C1C(C2=C(CCCC2=O)NC=1C)c1cccc(c1)I)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1786 |
| logD: | 1.2828 |
| logSw: | -4.9996 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.969 |
| InChI Key: | PGMLMZRSYVQHRX-IBGZPJMESA-N |