DU-1302 free base
N-(8a-methyl-6-propan-2-ylspiro[7,8-dihydro-4aH-1,2,4-benzotrioxine-3,4'-cyclohexane]-1'-yl)-N'-(7-chloroquinolin-4-yl)ethane-1,2-diamine
Also Known As: DU-1302 free base|DU-1320|J3.325.151C|1,2-Ethanediamine, N-(7-chloro-4-quinolinyl)-N'-(4a,7,8,8a-tetrahydro-8a-methyl-6-(1-methylethyl)spiro(1,2,4-benzotrioxin-3,1'-cyclohexan)-4'-yl)-|1,2-Ethanediamine, N1-(7-chloro-4-quinolinyl)-N2-(4a,7,8,8a-tetrahydro-8a-methyl-6-(1-methylethyl)spiro(1,2,4-benzotrioxin-3,1'-cyclohexan)-4'-yl)-|N-(4a-Methyl-7-isopropyl-4a,5,6,8a-tetrahydrospiro[2H-1,3,4-trioxanaphthalene-2,1 -cyclohexane]-4 -yl)-N -(7-chloroquinoline-4-yl)-1,2-ethanediamine|N-(8a-methyl-6-propan-2-ylspiro[7,8-dihydro-4aH-1,2,4-benzotrioxine-3,4'-cyclohexane]-1'-yl)-N'-(7-chloroquinolin-4-yl)ethane-1,2-diamine|N2-[8a-methyl-6-(propan-2-yl)-4a,7,8,8a-tetrahydrospiro[1,2,4-benzotrioxine-3,1'-cyclohexan]-4'-yl]-N1-(7-chloroquinolin-4-yl)ethane-1,2-diamine
| Molecular Formula | C27H36ClN3O3 |
|---|---|
| Molecular Weight | 485.2445 g/mol |
| LogP | 6.0105 |
| Topological Polar Surface Area | 64.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 485.2445 |
| Monoisotopic Mass | 485.2445 |
| Heavy Atoms | 34 |
| Complexity | 1050.5922 |
Chemical Identifiers
| CAS Number | 367265-64-3 |
|---|---|
| SMILES | CC(C)C1=CC2C(CC1)(OOC3(O2)CCC(CC3)NCCNC4=C5C=CC(=CC5=NC=C4)Cl)C |
Product Overview
DU-1302 free base (CAS 367265-64-3), with molecular formula C27H36ClN3O3 and molecular weight 485.2445 g/mol. IUPAC: N-(8a-methyl-6-propan-2-ylspiro[7,8-dihydro-4aH-1,2,4-benzotrioxine-3,4'-cyclohexane]-1'-yl)-N'-(7-chloroquinolin-4-yl)ethane-1,2-diamine.