Cas no 57000-13-2 (1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-[(phenylmethyl)amino]-)
![1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-[(phenylmethyl)amino]- structure](https://ossimg.kuujia.com/scimg/57500/57000-13-2x500.png)
57000-13-2 structure
Product Name:1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-[(phenylmethyl)amino]-
CAS No:57000-13-2
MF:C14H15N5O2
MW:285.301202058792
CID:368863
PubChem ID:100382
Update Time:2025-04-19
1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-[(phenylmethyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-[(phenylmethyl)amino]-
- 8-(benzylamino)-1,3-dimethyl-7H-purine-2,6-dione
- 8-Benzylaminotheophylline
- 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-((phenylmethyl)amino)-
- 3,7-Dihydro-1,3-dimethyl-8-((phenylmethyl)amino)-1H-purine-2,6-dione
- 8-(benzylamino)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
- 8-(Benzylamino)theophylline
- 8-< (phenylmethyl)amino> theophylline
- 8-Be
- 8-benzylamino-1,3-dimethyl-3,7(9)-dihydro-purine-2,6-dione
- 8-benzylamino-1,3-dimethyl-3,7-dihydro-purine-2,6-dione
- BRN 0309350
- ChemDiv2_000695
- NSC293946
- EU-0073660
- Oprea1_603806
- DTXSID40205613
- Oprea1_456132
- NSC-293946
- HMS1370P13
- Theophylline, 8-benzylamino-
- SR-01000452382
- SR-01000452382-1
- CCG-108040
- NSC 293946
- AKOS001626183
- 57000-13-2
- SCHEMBL10369640
- FEUMMCAKDXMNOR-UHFFFAOYSA-N
-
- Inchi： 1S/C14H15N5O2/c1-18-11-10(12(20)19(2)14(18)21)16-13(17-11)15-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H2,15,16,17)
- InChI Key： FEUMMCAKDXMNOR-UHFFFAOYSA-N
- SMILES： O=C1C2=C(N=C(NCC3C=CC=CC=3)N2)N(C)C(N1C)=O
Computed Properties
- Exact Mass: 285.12275
- Monoisotopic Mass: 285.122575
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 424
- 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
- Topological Polar Surface Area: 81.3
- XLogP3: 1.4
Experimental Properties
- Density: 1.404
- Boiling Point: 539.3°Cat760mmHg
- Flash Point: 280°C
- Refractive Index: 1.685
- PSA: 81.33
- LogP: 0.64540
1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-[(phenylmethyl)amino]- Related Literature
-
J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
57000-13-2 (1H-Purine-2,6-dione,3,9-dihydro-1,3-dimethyl-8-[(phenylmethyl)amino]-) Related Products
- 75922-48-4(1,3-Diethyl-8-phenylxanthine)
- 19844-93-0(3-benzyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione)
- 961-45-5(1,3-Dimethyl-8-phenylxanthine)
- 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)
Recommended suppliers
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
Hangzhou Cedareal Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
Nanjing Jubai Biopharm
Gold Member
Audited Supplier
CN Supplier
Bulk
Shaanxi pure crystal photoelectric technology co. LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
