Cas no 87629-31-0 (1,3-Bis(4-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;hydrochloride)
![1,3-Bis(4-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;hydrochloride structure](https://ossimg.kuujia.com/scimg/88000/87629-31-0x500.png)
87629-31-0 structure
Product Name:1,3-Bis(4-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;hydrochloride
CAS No:87629-31-0
MF:C18H16ClF2N3
MW:347.789549827576
CID:654390
Update Time:2023-08-03
1,3-Bis(4-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;hydrochloride Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazolo[4,3-c]pyridine, 1,3-bis(4-fluorophenyl)-4,5,6,7-tetrahydro-,monohydrochloride
- 1h-pyrazolo[4,3-c]pyridine,1,3-bis(4-fluorophenyl)-4,5,6,7-tetrahydro-,hydrochloride
- BDBM50225678
- 1,3-Bis(4-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;hydrochloride
-
- Inchi： 1S/C18H15F2N3.ClH/c19-13-3-1-12(2-4-13)18-16-11-21-10-9-17(16)23(22-18)15-7-5-14(20)6-8-15;/h1-8,21H,9-11H2;1H
- InChI Key： QSRBBZOELQMQFJ-UHFFFAOYSA-N
- SMILES： Cl.FC1C=CC(=CC=1)N1C2CCNCC=2C(C2C=CC(=CC=2)F)=N1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 2
- Complexity: 392
- Topological Polar Surface Area: 29.8
1,3-Bis(4-fluorophenyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;hydrochloride Related Literature
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Xiuxia Yang,Lei Zhao,Zhichao Liu,Shuyu Tian,Hao Zhang,Xuhui Xu,Jianbei Qiu,Xue Yu Phys. Chem. Chem. Phys., 2020,22, 16294-16300
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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