AC1MKSSD
2-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12524126|2-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione|3-[(6-chloro-2-fluorophenyl)methyl]-8-ethyl-1,7-dimethyl-1,3,5-trihydro-4-imid azolino[1,2-h]purine-2,4-dione
CAS: 876902-17-9
| Molecular Formula | C18H17ClFN5O2 |
|---|---|
| Molecular Weight | 389.10547 g/mol |
| LogP | 2.31852 |
| Topological Polar Surface Area | 66.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.10547 |
| Monoisotopic Mass | 389.10547 |
| Heavy Atoms | 27 |
| Complexity | 1307.7512 |
Chemical Identifiers
| CAS Number | 876902-17-9 |
|---|---|
| SMILES | CCN1C(=CN2C1=NC3=C2C(=O)N(C(=O)N3C)CC4=C(C=CC=C4Cl)F)C |
Product Overview
AC1MKSSD (CAS 876902-17-9), with molecular formula C18H17ClFN5O2 and molecular weight 389.10547 g/mol. IUPAC: 2-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-4,7-dimethylpurino[7,8-a]imidazole-1,3-dione.
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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