Cas no 126824-11-1 (6-(4-methyl-1-piperazinyl)-3-nitro-2-Pyridinamine)
126824-11-1 structure
Product Name:6-(4-methyl-1-piperazinyl)-3-nitro-2-Pyridinamine
CAS No:126824-11-1
MF:C10H15N5O2
MW:237.258401155472
CID:1103767
PubChem ID:21354525
Update Time:2025-04-20
6-(4-methyl-1-piperazinyl)-3-nitro-2-Pyridinamine Chemical and Physical Properties
Names and Identifiers
-
- 6-(4-methyl-1-piperazinyl)-3-nitro-2-Pyridinamine
- AKOS017557344
- STL417820
- 6-(4-methylpiperazin-1-yl)-3-nitropyridin-2-amine
- BBL034547
- VS-12588
- 126824-11-1
- DB-124125
- 6-(4-methyl-1-piperazinyl)-3-nitro-2-pyridinylamine
- AP-970/43507172
- 6-(4-methylpiperazino)-3-nitro-2-pyridinamine
- SCHEMBL3568875
- PDSWRHMCPBRBPJ-UHFFFAOYSA-N
-
- Inchi： 1S/C10H15N5O2/c1-13-4-6-14(7-5-13)9-3-2-8(15(16)17)10(11)12-9/h2-3H,4-7H2,1H3,(H2,11,12)
- InChI Key： PDSWRHMCPBRBPJ-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=C(N)N=C(C=C1)N1CCN(C)CC1)=O
Computed Properties
- Exact Mass: 237.12257474g/mol
- Monoisotopic Mass: 237.12257474g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 274
- 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: 1.2
- Topological Polar Surface Area: 91.2?2
6-(4-methyl-1-piperazinyl)-3-nitro-2-Pyridinamine Related Literature
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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