Cas no 762302-87-4 (PYRIMIDINE, 2-(1,1-DIMETHYLETHYL)-4-(1-PIPERAZINYL)-6-PROPYL-)
762302-87-4 structure
Product Name:PYRIMIDINE, 2-(1,1-DIMETHYLETHYL)-4-(1-PIPERAZINYL)-6-PROPYL-
CAS No:762302-87-4
MF:C15H26N4
MW:262.393743038177
CID:3521009
PubChem ID:22349857
Update Time:2025-04-21
PYRIMIDINE, 2-(1,1-DIMETHYLETHYL)-4-(1-PIPERAZINYL)-6-PROPYL- Chemical and Physical Properties
Names and Identifiers
-
- PYRIMIDINE, 2-(1,1-DIMETHYLETHYL)-4-(1-PIPERAZINYL)-6-PROPYL-
- BTAKRXXDPHBOAH-UHFFFAOYSA-N
- DB-104820
- 762302-87-4
- 2-tert-butyl-4-piperazin-1-yl-6-propylpyrimidine
- 2-tert-butyl-4-piperazin-1-yl-6-propyl-pyrimidine
- SCHEMBL1763839
-
- Inchi： 1S/C15H26N4/c1-5-6-12-11-13(19-9-7-16-8-10-19)18-14(17-12)15(2,3)4/h11,16H,5-10H2,1-4H3
- InChI Key： BTAKRXXDPHBOAH-UHFFFAOYSA-N
- SMILES： C1(C(C)(C)C)=NC(CCC)=CC(N2CCNCC2)=N1
Computed Properties
- Exact Mass: 262.21574685Da
- Monoisotopic Mass: 262.21574685Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 268
- 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: 2.9
- Topological Polar Surface Area: 41.1?2
PYRIMIDINE, 2-(1,1-DIMETHYLETHYL)-4-(1-PIPERAZINYL)-6-PROPYL- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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