Cas no 116378-72-4 (1H-Pyrazolo[3,4-g]quinoxaline(9CI))
116378-72-4 structure
Product Name:1H-Pyrazolo[3,4-g]quinoxaline(9CI)
CAS No:116378-72-4
MF:C9H6N4
MW:170.170740604401
CID:132578
PubChem ID:18999829
Update Time:2025-04-19
1H-Pyrazolo[3,4-g]quinoxaline(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazolo[3,4-g]quinoxaline(9CI)
- 1H-pyrazolo[3,4-g]quinoxaline
- 1H-Pyrazolo[3,4-g]quinoxaline (9CI)
- SCHEMBL842549
- pyrazolo[4,5-g]quinoxaline
- 116378-72-4
- DTXSID50597253
-
- Inchi: 1S/C9H6N4/c1-2-11-9-4-7-6(5-12-13-7)3-8(9)10-1/h1-5H,(H,12,13)
- InChI Key: HASUOSDQPRQNBS-UHFFFAOYSA-N
- SMILES: N1C2C=C3C(=CC=2C=N1)N=CC=N3
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: 0.5
- Topological Polar Surface Area: 54.5?2
Experimental Properties
- PSA: 54.46
1H-Pyrazolo[3,4-g]quinoxaline(9CI) Related Literature
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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