Cas no 144872-01-5 (Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-,1,1-dimethylethyl ester)
![Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-,1,1-dimethylethyl ester structure](https://ossimg.kuujia.com/scimg/145000/144872-01-5x500.png)
144872-01-5 structure
Product Name:Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-,1,1-dimethylethyl ester
CAS No:144872-01-5
MF:C26H39N5O5
MW:501.618366479874
CID:102060
Update Time:2024-01-24
Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-,1,1-dimethylethyl ester Chemical and Physical Properties
Names and Identifiers
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- Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-,1,1-dimethylethyl ester
- Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbo...
- Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-,1,1-dimethy
- Glycine, N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-, 1,1-dimethylethyl ester
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- Inchi： 1S/C26H39N5O5/c1-7-14-30-22(27)21(24(34)31(15-8-2)25(30)35)29-23(33)19(9-3)17-10-12-18(13-11-17)28-16-20(32)36-26(4,5)6/h10-13,19,28H,7-9,14-16,27H2,1-6H3,(H,29,33)
- InChI Key： MUUGDKKKEBNJEP-UHFFFAOYSA-N
- SMILES： C(OC(C)(C)C)(=O)CNC1=CC=C(C(C(NC2=C(N)N(CCC)C(=O)N(CCC)C2=O)=O)CC)C=C1
Computed Properties
- Exact Mass: 501.295
- Monoisotopic Mass: 501.295
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 36
- Rotatable Bond Count: 13
- Complexity: 842
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 134A^2
Experimental Properties
- Density: 1.20±0.1 g/cm3(Predicted)
- pka: 12.53±0.20(Predicted)
Glycine,N-[4-[1-[[(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1,3-dipropyl-5-pyrimidinyl)amino]carbonyl]propyl]phenyl]-,1,1-dimethylethyl ester Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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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
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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