Cas no 228253-33-6 (1H-Imidazo[4,5-c][1,5]naphthyridine (9CI))
228253-33-6 structure
Product Name:1H-Imidazo[4,5-c][1,5]naphthyridine (9CI)
CAS No:228253-33-6
MF:C9H6N4
MW:170.170740604401
CID:245096
PubChem ID:22172728
Update Time:2025-04-19
1H-Imidazo[4,5-c][1,5]naphthyridine (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Imidazo[4,5-c][1,5]naphthyridine (9CI)
- 3H-imidazo[4,5-c][1,5]naphthyridine
- SCHEMBL192176
- IDUUCDZKSKUCOP-UHFFFAOYSA-N
- DTXSID50623208
- 1H-Imidazo[4,5-c][1,5]naphthyridine(9CI)
- 228253-33-6
- 1h-imidazo[4,5-c][1,5]naphthyridine
-
- Inchi: 1S/C9H6N4/c1-2-6-8(10-3-1)9-7(4-11-6)12-5-13-9/h1-5H,(H,12,13)
- InChI Key: IDUUCDZKSKUCOP-UHFFFAOYSA-N
- SMILES: N1C=NC2C3C(=CC=CN=3)N=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: 0.8
- Topological Polar Surface Area: 54.5?2
Experimental Properties
- PSA: 54.46
1H-Imidazo[4,5-c][1,5]naphthyridine (9CI) Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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