Cas no 141305-95-5 (4(3H)-Quinazolinone, 3-[(2-fluorophenyl)methyl]-)
![4(3H)-Quinazolinone, 3-[(2-fluorophenyl)methyl]- structure](https://ossimg.kuujia.com/scimg/141500/141305-95-5x500.png)
141305-95-5 structure
Product Name:4(3H)-Quinazolinone, 3-[(2-fluorophenyl)methyl]-
CAS No:141305-95-5
MF:C15H11FN2O
MW:254.259046792984
CID:1304854
PubChem ID:5157400
Update Time:2025-04-20
4(3H)-Quinazolinone, 3-[(2-fluorophenyl)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 4(3H)-Quinazolinone, 3-[(2-fluorophenyl)methyl]-
- CCG-307207
- AKOS001137314
- 3-(2-Fluorobenzyl)quinazolin-4(3H)-one
- SR-01000459525-1
- Oprea1_616993
- 4(3h)-quinazolinone,3-[(2-fluorophenyl)methyl]-
- Z91652473
- SR-01000459525
- 3-(2-FLUOROBENZYL)-4(3H)-QUINAZOLINONE
- 141305-95-5
- 3-[(2-fluorophenyl)methyl]-3,4-dihydroquinazolin-4-one
-
- Inchi： 1S/C15H11FN2O/c16-13-7-3-1-5-11(13)9-18-10-17-14-8-4-2-6-12(14)15(18)19/h1-8,10H,9H2
- InChI Key： KOQXBNPNOBNYTG-UHFFFAOYSA-N
- SMILES： FC1C=CC=CC=1CN1C=NC2C=CC=CC=2C1=O
Computed Properties
- Exact Mass: 254.08563
- Monoisotopic Mass: 254.08554114g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 371
- 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: 2.5
- Topological Polar Surface Area: 32.7?2
Experimental Properties
- PSA: 32.67
4(3H)-Quinazolinone, 3-[(2-fluorophenyl)methyl]- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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