Cas no 5388-11-4 (4(3H)-Quinazolinone, 3-(phenylmethyl)-)
5388-11-4 structure
Product Name:4(3H)-Quinazolinone, 3-(phenylmethyl)-
CAS No:5388-11-4
MF:C15H12N2O
MW:236.268583297729
CID:356141
PubChem ID:616746
Update Time:2025-04-19
4(3H)-Quinazolinone, 3-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 4(3H)-Quinazolinone, 3-(phenylmethyl)-
- SR-01000471536-1
- SMR000420339
- HMS1729G18
- Oprea1_566430
- 3-Benzyl-4(3H)-quinazolinone
- 3-Benzyl-3H-quinazolin-4-one
- IBWZSUGBNKITMC-UHFFFAOYSA-N
- 5388-11-4
- CHEMBL1889094
- SR-01000471536
- 3-benzylquinazolin-4(3H)-one
- 3-Benzyl-4(3H)-quinazolinone #
- MLS000780156
- HMS2803C08
- SCHEMBL16210930
- Oprea1_707295
- DTXSID90346964
- 3-benzylquinazolin-4-one
- 3-Benzyl-3,4-dihydro-4-oxoquinazoline
- Cambridge id 6660440
- AKOS001137315
- Z91652478
-
- Inchi: 1S/C15H12N2O/c18-15-13-8-4-5-9-14(13)16-11-17(15)10-12-6-2-1-3-7-12/h1-9,11H,10H2
- InChI Key: IBWZSUGBNKITMC-UHFFFAOYSA-N
- SMILES: O=C1C2C=CC=CC=2N=CN1CC1C=CC=CC=1
Computed Properties
- Exact Mass: 236.09506
- Monoisotopic Mass: 236.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 333
- 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: 2.2
- Topological Polar Surface Area: 32.7?2
Experimental Properties
- PSA: 32.67
4(3H)-Quinazolinone, 3-(phenylmethyl)- Related Literature
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
5388-11-4 (4(3H)-Quinazolinone, 3-(phenylmethyl)-) Related Products
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- 17329-31-6(6-Amino-3H-quinazolin-4-one)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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