Cas no 37294-42-1 (Imidazoquinazoline)
Imidazoquinazoline structure
Product Name:Imidazoquinazoline
CAS No:37294-42-1
MF:C9H6N4
MW:170.170740604401
CID:292393
PubChem ID:45078362
Update Time:2025-04-19
Imidazoquinazoline Chemical and Physical Properties
Names and Identifiers
-
- Imidazoquinazoline
- 3H-imidazo[4,5-h]quinazoline
- 37294-42-1
- DTXSID30663501
- SCHEMBL563678
- 1h-imidazo[4,5-h]quinazoline
- 53974-24-6
-
- Inchi： 1S/C9H6N4/c1-2-7-9(13-5-11-7)8-6(1)3-10-4-12-8/h1-5H,(H,11,13)
- InChI Key： KJMFQJFNQYWQAV-UHFFFAOYSA-N
- SMILES： N1C=NC2C3C(=CN=CN=3)C=CC1=2
Computed Properties
- Exact Mass: 170.05938
- Monoisotopic Mass: 170.059246208g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 196
- 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: 1.1
- Topological Polar Surface Area: 54.5?2
Experimental Properties
- PSA: 54.46
Imidazoquinazoline Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Hui Liu,Deyong Su,Guolin Cheng,Jimin Xu,Xinyan Wang,Yuefei Hu Org. Biomol. Chem., 2010,8, 1899-1904
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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