Cas no 68435-53-0 (Urea, N-phenyl-N'-2-quinolinyl-)
68435-53-0 structure
Product Name:Urea, N-phenyl-N'-2-quinolinyl-
CAS No:68435-53-0
MF:C16H13N3O
MW:263.293923139572
CID:393190
PubChem ID:2812761
Update Time:2025-04-19
Urea, N-phenyl-N'-2-quinolinyl- Chemical and Physical Properties
Names and Identifiers
-
- Urea, N-phenyl-N'-2-quinolinyl-
- 1-phenyl-3-quinolin-2-ylurea
- SMR000567528
- 68435-53-0
- CCG-239544
- MLS001181784
- CHEMBL1351104
- HMS2871E19
- Oprea1_439175
- DTXSID10384621
-
- Inchi: 1S/C16H13N3O/c20-16(17-13-7-2-1-3-8-13)19-15-11-10-12-6-4-5-9-14(12)18-15/h1-11H,(H2,17,18,19,20)
- InChI Key: AQKFDYCJMPYKGG-UHFFFAOYSA-N
- SMILES: O=C(NC1C=CC=CC=1)NC1=CC=C2C=CC=CC2=N1
Computed Properties
- Exact Mass: 263.10599
- Monoisotopic Mass: 263.105862047g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 328
- 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: 3.1
- Topological Polar Surface Area: 54?2
Experimental Properties
- PSA: 54.02
Urea, N-phenyl-N'-2-quinolinyl- 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
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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