Cas no 35873-43-9 (1h-purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-heptyl-)
35873-43-9 structure
Product Name:1h-purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-heptyl-
CAS No:35873-43-9
MF:C14H22N4O2
MW:278.350082874298
CID:920783
PubChem ID:97134
Update Time:2025-04-19
1h-purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-heptyl- Chemical and Physical Properties
Names and Identifiers
-
- 1h-purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-heptyl-
- 8-heptyl-1,3-dimethyl-7H-purine-2,6-dione
- 3,7-Dihydro-1,3-dimethyl-8-heptyl-1H-purine-2,6-dione
- 8-heptyl-1,3-dimethyl-3,7-dihydro-1h-purine-2,6-dione
- 8-heptyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
- 8-n-Heptyl-theophyllin
- AC1L3XWC
- AC1Q6LBJ
- BRN 1135622
- NCIOpen2_006828
- NSC101794
- SureCN4222552
- 35873-43-9
- NSC 101794
- DTXSID80189428
- SCHEMBL4222552
- NSC-101794
-
- Inchi： 1S/C14H22N4O2/c1-4-5-6-7-8-9-10-15-11-12(16-10)17(2)14(20)18(3)13(11)19/h4-9H2,1-3H3,(H,15,16)
- InChI Key： IDRUVEWEPXUION-UHFFFAOYSA-N
- SMILES： O=C1C2=C(N=C(CCCCCCC)N2)N(C)C(N1C)=O
Computed Properties
- Exact Mass: 277.16663
- Monoisotopic Mass: 278.17427596g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 6
- Complexity: 374
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.3
- Topological Polar Surface Area: 69.3?2
Experimental Properties
- PSA: 66.4
- LogP: 1.47320
1h-purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-heptyl- Related Literature
-
Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
35873-43-9 (1h-purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-heptyl-) Related Products
- 35873-49-5(8-Cyclopentyl-1,3-dimethylxanthine)
- 136199-02-5(KW 3902)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
Recommended suppliers
Nanjing Jubai Biopharm
Gold Member
Audited Supplier
CN Supplier
Bulk
Xiamen PinR Bio-tech Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Wuhan Comings Biotechnology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
NewCan Biotech Limited
Gold Member
Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
