Pamabrom
Properties
- Molecular formula
- C11H18BrN5O3
- Molar mass
- 348.20 g/mol
- Exact mass
- 347.0593 Da
- Melting point
- 300 °C (decomposes)
- logP
- -0.56Crippen estimate
- Polar surface area
- 118.9 Ų
- H-bond donors / acceptors
- 3 / 5
- Rotatable bonds
- 1
Identifiers
CAS number
606-04-2SMILES
CC(C)(N)CO.Cn1c(=O)c2nc(Br)[nH]c2n(C)c1=OInChIKey
ATOTUUBRFJHZQG-UHFFFAOYSA-NInChI
InChI=1S/C7H7BrN4O2.C4H11NO/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14;1-4(2,5)3-6/h1-2H3,(H,9,10);6H,3,5H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- 1H-Purine-2,6-dione, 8-bromo-3,9-dihydro-1,3-dimethyl-, compd. with 2-amino-2-methyl-1-propanol (1:1)
- Theophylline, 8-bromo-, compd. with 2-amino-2-methyl-1-propanol (1:1)
- 1H-Purine-2,6-dione, 8-bromo-3,7-dihydro-1,3-dimethyl-, compd. with 2-amino-2-methyl-1-propanol (1:1)
- 1-Propanol, 2-amino-2-methyl-, compd. with 8-bromotheophylline (1:1)
- 1-Propanol, 2-amino-2-methyl-, compd. with 8-bromo-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:1)
- 2-Amino-2-methyl-1-propanol 8-bromotheophyllinate
- Predema
- Sunril
- Premsyn PMS
Work with Pamabrom
Similar compounds
1,3-Dimethyluric acid944-73-049 % similar
8-Chlorotheophylline85-18-747 % similar
8-(Dimethylamino)-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dione5426-47-144 % similar
3,9-Dihydro-1,3-dimethyl-8-(phenylmethyl)-1H-purine-2,6-dione2879-15-442 % similar
Aminophylline317-34-041 % similar
Theophylline58-55-940 % similar
1,3-Dimethylxanthine monohydrate5967-84-038 % similar
Dimenhydrinate523-87-534 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds