AC1MRQSS
17-[2-(3,4-dimethoxyphenyl)ethyl]-13-(2-methylpropyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one
Also Known As: 11-(3,4-dimethoxyphenethyl)-3-isobutyl-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one|11-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methylpropyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
| Molecular Formula | C26H27N5O3 |
|---|---|
| Molecular Weight | 457.2114 g/mol |
| LogP | 4.2103 |
| Topological Polar Surface Area | 84.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.2114 |
| Monoisotopic Mass | 457.2114 |
| Heavy Atoms | 34 |
| Complexity | 1568.4108 |
Chemical Identifiers
| CAS Number | 836626-68-7 |
|---|---|
| SMILES | CC(C)CN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CCC5=CC(=C(C=C5)OC)OC |
Product Overview
AC1MRQSS (CAS 836626-68-7), with molecular formula C26H27N5O3 and molecular weight 457.2114 g/mol. IUPAC: 17-[2-(3,4-dimethoxyphenyl)ethyl]-13-(2-methylpropyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one.
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