Cas no 460053-58-1 (3-benzoyl-7-azaindole)
3-benzoyl-7-azaindole structure
Product Name:3-benzoyl-7-azaindole
CAS No:460053-58-1
MF:C14H10N2O
MW:222.24200296402
CID:2152136
PubChem ID:10998603
Update Time:2025-04-21
3-benzoyl-7-azaindole Chemical and Physical Properties
Names and Identifiers
-
- 3-benzoyl-7-azaindole
- 460053-58-1
- SCHEMBL878719
- DB-365951
- SDTVSOYPNNRGOJ-UHFFFAOYSA-N
- 3-BENZOYL-1H-PYRROLO[2,3-B]PYRIDINE
-
- MDL： MFCD09999130
- Inchi： 1S/C14H10N2O/c17-13(10-5-2-1-3-6-10)12-9-16-14-11(12)7-4-8-15-14/h1-9H,(H,15,16)
- InChI Key： SDTVSOYPNNRGOJ-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1)C1=CNC2C1=CC=CN=2
Computed Properties
- Exact Mass: 222.079312947Da
- Monoisotopic Mass: 222.079312947Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 286
- 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: 2.7
- Topological Polar Surface Area: 45.8?2
3-benzoyl-7-azaindole Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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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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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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