Cas no 1791-51-1 (4(1H)-Quinazolinone, 2-[(4-methylphenyl)amino]-)
![4(1H)-Quinazolinone, 2-[(4-methylphenyl)amino]- structure](https://ossimg.kuujia.com/scimg/2000/1791-51-1x500.png)
1791-51-1 structure
Product Name:4(1H)-Quinazolinone, 2-[(4-methylphenyl)amino]-
CAS No:1791-51-1
MF:C15H13N3O
MW:251.283222913742
CID:1365983
PubChem ID:135885464
Update Time:2025-04-20
4(1H)-Quinazolinone, 2-[(4-methylphenyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 4(1H)-Quinazolinone, 2-[(4-methylphenyl)amino]-
- 4(1h)-quinazolinone,2-[(4-methylphenyl)amino]-
- 1791-51-1
- 2-(p-tolyl-amino)-4-quinazolone
-
- Inchi： 1S/C15H13N3O/c1-10-6-8-11(9-7-10)16-15-17-13-5-3-2-4-12(13)14(19)18-15/h2-9H,1H3,(H2,16,17,18,19)
- InChI Key： MFFLANMMDQEHDT-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=CC=2N=C(N1)NC1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 251.10599
- Monoisotopic Mass: 251.105862047g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 372
- 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: 2.4
- Topological Polar Surface Area: 53.5?2
Experimental Properties
- PSA: 53.49
4(1H)-Quinazolinone, 2-[(4-methylphenyl)amino]- Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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