Cas no 5750-80-1 (2,4,6(1H,3H,5H)-Pyrimidinetrione,5-bromo-5-phenyl-)
5750-80-1 structure
Product Name:2,4,6(1H,3H,5H)-Pyrimidinetrione,5-bromo-5-phenyl-
CAS No:5750-80-1
MF:C10H16N4O3
MW:240.259041786194
CID:380724
PubChem ID:2866566
Update Time:2025-04-19
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-bromo-5-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-bromo-5-phenyl-
- 2-[5-(2-aminoethylamino)-2-nitroanilino]ethanol
- 2-[5-(2-Amino-ethylamino)-2-nitro-phenylamino]-ethanol
- ethanol, 2-[[5-[(2-aminoethyl)amino]-2-nitrophenyl]amino]-
- AB00095744-01
- CBKinase1_013292
- AKOS000288818
- BRD-K04203650-001-01-2
- 5750-80-1
- Cambridge id 5750801
- DTXSID20386590
- CBKinase1_000892
-
- Inchi： 1S/C10H16N4O3/c11-3-4-12-8-1-2-10(14(16)17)9(7-8)13-5-6-15/h1-2,7,12-13,15H,3-6,11H2
- InChI Key： NZVISMNKEXWNQN-UHFFFAOYSA-N
- SMILES： OCCNC1C(=CC=C(C=1)NCCN)[N+](=O)[O-]
Computed Properties
- Exact Mass: 240.12238
- Monoisotopic Mass: 240.12224039g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 234
- 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: 0.7
- Topological Polar Surface Area: 116?2
Experimental Properties
- PSA: 113.45
2,4,6(1H,3H,5H)-Pyrimidinetrione,5-bromo-5-phenyl- Related Literature
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
5750-80-1 (2,4,6(1H,3H,5H)-Pyrimidinetrione,5-bromo-5-phenyl-) Related Products
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