XBAMXMSYFWKBCH-GCNRTMQZSA-N
8-[(2E)-2-[(Z)-2-bromo-3-phenylprop-2-enylidene]hydrazinyl]-3-methyl-7-(2-methylpropyl)purine-2,6-dione
Also Known As: BAS 00363947|AG-690/09682028|2-bromo-3-phenylacrylaldehyde (7-isobutyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazone|(1E,2Z)-2-bromo-3-phenyl-2-propenal (7-isobutyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)hydrazone|8-[((3Z,1E)-3-bromo-4-phenyl-1-azabuta-1,3-dienyl)amino]-3-methyl-7-(2-methylp ropyl)-1,3,7-trihydropurine-2,6-dione|8-[(2E)-2-[(Z)-2-bromo-3-phenylprop-2-enylidene]hydrazinyl]-3-methyl-7-(2-methylpropyl)purine-2,6-dione
| Molecular Formula | C19H21BrN6O2 |
|---|---|
| Molecular Weight | 444.09094 g/mol |
| LogP | 2.913 |
| Topological Polar Surface Area | 97.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.09094 |
| Monoisotopic Mass | 444.09094 |
| Heavy Atoms | 28 |
| Complexity | 1154.866 |
Chemical Identifiers
| CAS Number | 331259-75-7 |
|---|---|
| SMILES | CC(C)CN1C2=C(N=C1N/N=C/C(=C/C3=CC=CC=C3)/Br)N(C(=O)NC2=O)C |
Product Overview
XBAMXMSYFWKBCH-GCNRTMQZSA-N (CAS 331259-75-7), with molecular formula C19H21BrN6O2 and molecular weight 444.09094 g/mol. IUPAC: 8-[(2E)-2-[(Z)-2-bromo-3-phenylprop-2-enylidene]hydrazinyl]-3-methyl-7-(2-methylpropyl)purine-2,6-dione.
XBAMXMSYFWKBCH-GCNRTMQZSA-N is a custom synthesis product. We offer services from milligram to kilogram scale.
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