Cas no 1003025-24-8 (4(3H)-Quinazolinone, 6-(4-fluorophenyl)-)
1003025-24-8 structure
Product Name:4(3H)-Quinazolinone, 6-(4-fluorophenyl)-
CAS No:1003025-24-8
MF:C14H9FN2O
MW:240.232466459274
CID:2145328
Update Time:2023-11-19
4(3H)-Quinazolinone, 6-(4-fluorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 6-(4-fluorophenyl)-4-hydroxy-quinazoline
- BWLBQTUIVBSIHZ-UHFFFAOYSA-N
- 4-hydroxy-6-(4-fluorophenyl)-quinazoline
- CID 135907851
- 4(3H)-Quinazolinone, 6-(4-fluorophenyl)-
-
- Inchi： 1S/C14H9FN2O/c15-11-4-1-9(2-5-11)10-3-6-13-12(7-10)14(18)17-8-16-13/h1-8H,(H,16,17,18)
- InChI Key： BWLBQTUIVBSIHZ-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)C1=CC=C2C(C(NC=N2)=O)=C1
Computed Properties
- Exact Mass: 240.07
- Monoisotopic Mass: 240.07
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 350
- 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
- Topological Polar Surface Area: 41.5
- XLogP3: 2.5
4(3H)-Quinazolinone, 6-(4-fluorophenyl)- Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
1003025-24-8 (4(3H)-Quinazolinone, 6-(4-fluorophenyl)-) Related Products
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