Cas no 574738-93-5 (6-(3-chloropropoxy)-7-methoxyquinazolin-4(3H)-one)
574738-93-5 structure
Product Name:6-(3-chloropropoxy)-7-methoxyquinazolin-4(3H)-one
CAS No:574738-93-5
MF:C12H13ClN2O3
MW:268.696222066879
CID:2153405
PubChem ID:135589773
Update Time:2025-04-21
6-(3-chloropropoxy)-7-methoxyquinazolin-4(3H)-one Chemical and Physical Properties
Names and Identifiers
-
- 6-(3-chloropropoxy)-7-methoxyquinazolin-4(3H)-one
- 6-(3-chloropropoxy)-7-methoxyquinazoline-4-one
- 574738-93-5
- DB-333195
- BAARZNXBWRRHPB-UHFFFAOYSA-N
- AKOS004910594
- 6-(3-chloropropoxy)-7-methoxyquinazoline-4(3h)-one
- SCHEMBL1012438
- 6-(3-chloropropoxy)-4-hydroxy-7-methoxyquinazoline
- 7-methoxy-6-(3-chloropropoxy)quinazolin-4-one
- 6-(3-CHLOROPROPOXY)-7-METHOXY-3H-QUINAZOLIN-4-ONE
-
- Inchi： 1S/C12H13ClN2O3/c1-17-10-6-9-8(12(16)15-7-14-9)5-11(10)18-4-2-3-13/h5-7H,2-4H2,1H3,(H,14,15,16)
- InChI Key： BAARZNXBWRRHPB-UHFFFAOYSA-N
- SMILES： ClCCCOC1C(=CC2=C(C(NC=N2)=O)C=1)OC
Computed Properties
- Exact Mass: 268.0614700Da
- Monoisotopic Mass: 268.0614700Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 324
- 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: 1.6
- Topological Polar Surface Area: 59.9?2
6-(3-chloropropoxy)-7-methoxyquinazolin-4(3H)-one Related Literature
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1. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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