AC1MR8UB
4-benzyl-14-methyl-12,16-diphenyl-10-oxa-3,5,6,8,12,13-hexazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2,4,7,11(15),13-hexaene
Also Known As: 2-benzyl-10-methyl-8,11-diphenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
CAS: 845802-98-4
| Molecular Formula | C29H22N6O |
|---|---|
| Molecular Weight | 470.18552 g/mol |
| LogP | 5.49512 |
| Topological Polar Surface Area | 70.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 470.18552 |
| Monoisotopic Mass | 470.18552 |
| Heavy Atoms | 36 |
| Complexity | 1690.5079 |
Chemical Identifiers
| CAS Number | 845802-98-4 |
|---|---|
| SMILES | CC1=NN(C2=C1C(C3=C(O2)N=CN4C3=NC(=N4)CC5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7 |
Product Overview
AC1MR8UB (CAS 845802-98-4), with molecular formula C29H22N6O and molecular weight 470.18552 g/mol. IUPAC: 4-benzyl-14-methyl-12,16-diphenyl-10-oxa-3,5,6,8,12,13-hexazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2,4,7,11(15),13-hexaene.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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