Cas no 1236162-33-6 (2-amino-7-cyclobutyl-Imidazo[5,1-f][1,2,4]triazin-4(1H)-one)
1236162-33-6 structure
Product Name:2-amino-7-cyclobutyl-Imidazo[5,1-f][1,2,4]triazin-4(1H)-one
CAS No:1236162-33-6
MF:C9H11N5O
MW:205.216540575027
CID:1102698
PubChem ID:136701613
Update Time:2025-04-20
2-amino-7-cyclobutyl-Imidazo[5,1-f][1,2,4]triazin-4(1H)-one Chemical and Physical Properties
Names and Identifiers
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- 2-amino-7-cyclobutyl-Imidazo[5,1-f][1,2,4]triazin-4(1H)-one
- DTXSID201194210
- 2-Amino-7-cyclobutylimidazo[5,1-f][1,2,4]triazin-4(1H)-one
- 1236162-33-6
-
- Inchi: 1S/C9H11N5O/c10-9-12-8(15)6-4-11-7(14(6)13-9)5-2-1-3-5/h4-5H,1-3H2,(H3,10,12,13,15)
- InChI Key: ZBTHBYKSIHTDDY-UHFFFAOYSA-N
- SMILES: O=C1C2=CN=C(C3CCC3)N2N=C(N)N1
Computed Properties
- Exact Mass: 205.09635999g/mol
- Monoisotopic Mass: 205.09635999g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 325
- 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: 0.1
- Topological Polar Surface Area: 85.3?2
2-amino-7-cyclobutyl-Imidazo[5,1-f][1,2,4]triazin-4(1H)-one Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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