Cas no 5544-06-9 (4(1H)-Quinazolinone, 1-methyl-2-(methylamino)-)
5544-06-9 structure
Product Name:4(1H)-Quinazolinone, 1-methyl-2-(methylamino)-
CAS No:5544-06-9
MF:C10H11N3O
MW:189.213841676712
CID:351934
PubChem ID:12434809
Update Time:2025-04-19
4(1H)-Quinazolinone, 1-methyl-2-(methylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 4(1H)-Quinazolinone, 1-methyl-2-(methylamino)-
- 5544-06-9
- DTXSID10498156
- 1-Methyl-2-(methylamino)quinazolin-4(1H)-one
-
- Inchi： 1S/C10H11N3O/c1-11-10-12-9(14)7-5-3-4-6-8(7)13(10)2/h3-6H,1-2H3,(H,11,12,14)
- InChI Key： HFHRPIWYCKJMGJ-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=CC=2N(C)C(NC)=N1
Computed Properties
- Exact Mass: 189.09033
- Monoisotopic Mass: 189.090211983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 275
- 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: 0.7
- Topological Polar Surface Area: 44.7?2
Experimental Properties
- PSA: 44.7
4(1H)-Quinazolinone, 1-methyl-2-(methylamino)- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
5544-06-9 (4(1H)-Quinazolinone, 1-methyl-2-(methylamino)-) Related Products
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