Cas no 78932-78-2 (Isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-amino-5,7-dimethyl-)
![Isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-amino-5,7-dimethyl- structure](https://ossimg.kuujia.com/scimg/79000/78932-78-2x500.png)
78932-78-2 structure
Product Name:Isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-amino-5,7-dimethyl-
CAS No:78932-78-2
MF:C7H8N4O3
MW:196.163420677185
CID:533663
PubChem ID:12677988
Update Time:2025-04-19
Isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-amino-5,7-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-amino-5,7-dimethyl-
- 3-amino-5,7-dimethyl-[1,2]oxazolo[3,4-d]pyrimidine-4,6-dione
- 78932-78-2
- 3-Amino-5,7-dimethyl-isoxazolo[3,4-d]pyrimidine-4,6-(5H,7H)-dione
- 3-Amino-5,7-dimethyl[1,2]oxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
- SCHEMBL11009129
- 3-amino-5,7-dimethylisoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
- FSIUOVVEBJPIEV-UHFFFAOYSA-N
- DTXSID00506577
- 3-amino-5,7-dimethyl-isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione
-
- Inchi： 1S/C7H8N4O3/c1-10-5-3(4(8)14-9-5)6(12)11(2)7(10)13/h8H2,1-2H3
- InChI Key： FSIUOVVEBJPIEV-UHFFFAOYSA-N
- SMILES： O1C(=C2C(N(C)C(N(C)C2=N1)=O)=O)N
Computed Properties
- Exact Mass: 196.05964013g/mol
- Monoisotopic Mass: 196.05964013g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 295
- 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: -0.2
- Topological Polar Surface Area: 92.7?2
Isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-amino-5,7-dimethyl- Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
78932-78-2 (Isoxazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione, 3-amino-5,7-dimethyl-) Related Products
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