3-Mercaptoquinoline
4-[4-[(4-aminophenyl)methyl]phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: 3-Mercaptoquinoline|J1.214.475J|N-[4-(4-Aminobenzyl)phenyl]-5-norbornene-2,3-dicarboximide|2-(4-(4-Aminobenzyl)phenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione|N-[4-(4-Aminobenzyl)phenyl]-5-norbornene-2,3-carboxamide|N-[4-(4-Aminobenzyl)phenyl]norborna-2-ene-5,6-dicarbimide|4-[4-(4-Aminobenzyl)phenyl]-4-azatricyclo[5.2.1.02,6]deca-8-ene-3,5-dione|4-{4-[(4-aminophenyl)methyl]phenyl}-4-azatricyclo[5.2.1.0(2),]dec-8-ene-3,5-dione|4-{4-[(4-aminophenyl)methyl]phenyl}-4-azatricyclo[5.2.1.0,dec-8-ene-3,5-dione|4-{4-[(4-aminophenyl)methyl]phenyl}-4-azatricyclo[5.2.1.0<2,6>]dec-8-ene-3,5-d ione|4-{4-[(4-aminophenyl)methyl]phenyl}-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
| Molecular Formula | C22H20N2O2 |
|---|---|
| Molecular Weight | 344.15247 g/mol |
| LogP | 3.1711 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.15247 |
| Monoisotopic Mass | 344.15247 |
| Heavy Atoms | 26 |
| Complexity | 884.1634 |
Chemical Identifiers
| CAS Number | 76079-45-3 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)CC5=CC=C(C=C5)N |
Product Overview
3-Mercaptoquinoline (CAS 76079-45-3), with molecular formula C22H20N2O2 and molecular weight 344.15247 g/mol. IUPAC: 4-[4-[(4-aminophenyl)methyl]phenyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
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