AC1MXI3I
9-(4-chlorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: 9-(4-chlorophenyl)-1-methyl-3-(4-methylbenzyl)-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione|9-(4-chlorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-1H,2H,3H,4H,6H,7H,8H,9H-pyrimido[1,2-g]purine-2,4-dione|9-(4-chlorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione|9-(4-chlorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-1,3,5-trihydro-6H,7H,8H -1,3-diazaperhydroino[1,2-h]purine-2,4-dione
| Molecular Formula | C23H22ClN5O2 |
|---|---|
| Molecular Weight | 435.1462 g/mol |
| LogP | 3.44862 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 435.1462 |
| Monoisotopic Mass | 435.1462 |
| Heavy Atoms | 31 |
| Complexity | 1397.9141 |
Chemical Identifiers
| CAS Number | 862245-79-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(=O)C3=C(N=C4N3CCCN4C5=CC=C(C=C5)Cl)N(C2=O)C |
Product Overview
AC1MXI3I (CAS 862245-79-2), with molecular formula C23H22ClN5O2 and molecular weight 435.1462 g/mol. IUPAC: 9-(4-chlorophenyl)-1-methyl-3-[(4-methylphenyl)methyl]-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.