Cas no 1420827-71-9 (1-((2-Chloropyrimidin-4-yl)methyl)-1,4-diazepane hydrochloride)
1420827-71-9 structure
Product Name:1-((2-Chloropyrimidin-4-yl)methyl)-1,4-diazepane hydrochloride
CAS No:1420827-71-9
MF:C10H16Cl2N4
MW:263.166839599609
CID:2166412
Update Time:2023-08-05
1-((2-Chloropyrimidin-4-yl)methyl)-1,4-diazepane hydrochloride Chemical and Physical Properties
Names and Identifiers
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- 1-((2-Chloropyrimidin-4-yl)methyl)-1,4-diazepane hydrochloride
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- Inchi： 1S/C10H15ClN4.ClH/c11-10-13-4-2-9(14-10)8-15-6-1-3-12-5-7-15;/h2,4,12H,1,3,5-8H2;1H
- InChI Key： CUIJCWGUEUNTBE-UHFFFAOYSA-N
- SMILES： ClC1=NC=CC(CN2CCNCCC2)=N1.Cl
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 190
- Topological Polar Surface Area: 41
1-((2-Chloropyrimidin-4-yl)methyl)-1,4-diazepane hydrochloride Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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