Cas no 623903-29-7 (2-(4-oxo-3,4-dihydroquinazolin-2-yl)-1H-indole-3-carbaldehyde)
623903-29-7 structure
Product Name:2-(4-oxo-3,4-dihydroquinazolin-2-yl)-1H-indole-3-carbaldehyde
CAS No:623903-29-7
MF:C17H11N3O2
MW:289.288143396378
CID:2012178
PubChem ID:135800540
Update Time:2025-04-21
2-(4-oxo-3,4-dihydroquinazolin-2-yl)-1H-indole-3-carbaldehyde Chemical and Physical Properties
Names and Identifiers
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- 2-(4-oxo-3,4-dihydroquinazolin-2-yl)-1H-indole-3-carbaldehyde
- bouchardatine
- 623903-29-7
- CHEMBL3596962
- ConMedNP.2280
- 2-(2-[3-Formylindolyl])-(3H)-quinazolin-4-one
- GLXC-19154
- 2-(4-Oxo-3H-quinazolin-2-yl)-1H-indole-3-carbaldehyde
- 2-(4-oxo-1H-quinazolin-2-yl)-1H-indole-3-carbaldehyde
-
- Inchi： 1S/C17H11N3O2/c21-9-12-10-5-1-3-7-13(10)18-15(12)16-19-14-8-4-2-6-11(14)17(22)20-16/h1-9,18H,(H,19,20,22)
- InChI Key： ZDTNFKKWSCJPNF-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=CC=2N=C(C2=C(C=O)C3C=CC=CC=3N2)N1
Computed Properties
- Exact Mass: 289.085126602g/mol
- Monoisotopic Mass: 289.085126602g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 504
- 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: 1.355
- Topological Polar Surface Area: 74.3?2
2-(4-oxo-3,4-dihydroquinazolin-2-yl)-1H-indole-3-carbaldehyde Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
Related Categories
- Solvents and Organic Chemicals Organic Compounds Organoheterocyclic compounds Diazanaphthalenes Quinazolines
- Solvents and Organic Chemicals Organic Compounds Organoheterocyclic compounds Diazanaphthalenes Benzodiazines Quinazolines
- Natural Products and Extracts Plant Extracts Plant based Bouchardatia neurococca
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