Cas no 105891-73-4 (2,4(3H,5H)-Pyrimidinedione,5,5-diethyl-6-[(phenylmethyl)amino]-)
105891-73-4 structure
Product Name:2,4(3H,5H)-Pyrimidinedione,5,5-diethyl-6-[(phenylmethyl)amino]-
CAS No:105891-73-4
MF:C15H19N3O2
MW:273.330263376236
CID:196521
PubChem ID:135463945
Update Time:2025-04-19
2,4(3H,5H)-Pyrimidinedione,5,5-diethyl-6-[(phenylmethyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 2,4(3H,5H)-Pyrimidinedione,5,5-diethyl-6-[(phenylmethyl)amino]-
- 6-(benzylamino)-5,5-diethylpyrimidine-2,4-dione
- 2,4(3H,5H)-Pyrimidinedione, 5,5-diethyl-6-((phenylmethyl)amino)-
- 5,5-Diethyl-4-((phenylmethyl)imino)barbituric acid
- AC1MI8O2
- BRN 5576314
- LS-135166
- 105891-73-4
- DTXSID80147386
-
- Inchi: 1S/C15H19N3O2/c1-3-15(4-2)12(17-14(20)18-13(15)19)16-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H2,16,17,18,19,20)
- InChI Key: FLRPWGZXKMESPH-UHFFFAOYSA-N
- SMILES: O=C1C(/C(=N/CC2C=CC=CC=2)/NC(N1)=O)(CC)CC
Computed Properties
- Exact Mass: 273.147726857g/mol
- Monoisotopic Mass: 273.147726857g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 407
- 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: 2.3
- Topological Polar Surface Area: 70.6?2
2,4(3H,5H)-Pyrimidinedione,5,5-diethyl-6-[(phenylmethyl)amino]- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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