Theophylline, 7-allyl-8-(1-methylhydrazino)- structure

Theophylline, 7-allyl-8-(1-methylhydrazino)-

8-[amino(methyl)amino]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione

Also Known As: Theophylline, 7-allyl-8-(1-methylhydrazino)-|7-Allyl-8-(1-methylhydrazino)theophylline|KST-1B5661|N-Methyl-N-(7-allyltheophyllinyl-8)-hydrazine|5-26-18-00549 (Beilstein Handbook Reference)|7-ALLYL-8-(1-METHYLHYDRAZINYL)THEOPHYLLINE|1,3-dimethyl-8-(1-methylhydrazinyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1h-purine-2,6-dione|8-[amino(methyl)amino]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione|1,3-Dimethyl-8-(1-methylhydrazin-1-yl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione

CAS: 5651-35-4
Molecular Formula C11H16N6O2
Molecular Weight 264.13348 g/mol
Topological Polar Surface Area 87.7 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 264.13348
Monoisotopic Mass 264.13348
Heavy Atoms 19
Complexity 414.0

Chemical Identifiers

CAS Number 5651-35-4
SMILES CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(C)N)CC=C
InChIKey YSHGGEWDDCWGKN-UHFFFAOYSA-N

Product Overview

Theophylline, 7-allyl-8-(1-methylhydrazino)- (CAS 5651-35-4), with molecular formula C11H16N6O2 and molecular weight 264.13348 g/mol. IUPAC: 8-[amino(methyl)amino]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione.

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