8-sec-Butylamino-7-(4-fluoro-benzyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
8-(butan-2-ylamino)-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione
Also Known As: Oprea1_632296|Oprea1_837678|NCGC00027540-02|NCGC00027540-03|BAS 02999157|AB00397122-06|AB00397122-11|F0887-0093|8-sec-Butylamino-7-(4-fluoro-benzyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione|8-(sec-butylamino)-7-(4-fluorobenzyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione|8-(butan-2-ylamino)-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione|8-(butan-2-ylamino)-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione|8-[(butan-2-yl)amino]-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione|8-(sec-butylamino)-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione|7-[(4-fluorophenyl)methyl]-1,3-dimethyl-8-[(methylpropyl)amino]-1,3,7-trihydro purine-2,6-dione|8-(butan-2-ylamino)-7-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C18H22FN5O2 |
|---|---|
| Molecular Weight | 359.17575 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.17575 |
| Monoisotopic Mass | 359.17575 |
| Heavy Atoms | 26 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 333752-50-4 |
|---|---|
| SMILES | CCC(C)NC1=NC2=C(N1CC3=CC=C(C=C3)F)C(=O)N(C(=O)N2C)C |
| InChIKey | KZZDZDBAJIZPCE-UHFFFAOYSA-N |
Product Overview
8-sec-Butylamino-7-(4-fluoro-benzyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione (CAS 333752-50-4), with molecular formula C18H22FN5O2 and molecular weight 359.17575 g/mol. IUPAC: 8-(butan-2-ylamino)-7-[(4-fluorophenyl)methyl]-1,3-dimethylpurine-2,6-dione.
8-sec-Butylamino-7-(4-fluoro-benzyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione is a custom synthesis product. We offer services from milligram to kilogram scale.
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