Cas no 215925-70-5 (2,4-Quinazolinediamine, 5-(4-methylphenoxy)-)
215925-70-5 structure
Product Name:2,4-Quinazolinediamine, 5-(4-methylphenoxy)-
CAS No:215925-70-5
MF:C15H14N4O
MW:266.297862529755
CID:1402629
PubChem ID:4106338
Update Time:2025-04-20
2,4-Quinazolinediamine, 5-(4-methylphenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Quinazolinediamine, 5-(4-methylphenoxy)-
- 2,4-Diamino-5-(4-methylphenoxy)quinazoline
- BDBM50130956
- 5-(p-tolyloxy)quinazoline-2,4-diamine
- SCHEMBL6477195
- 5-p-Tolyloxy-quinazoline-2,4-diamine
- Oprea1_448894
- 5-(4-methylphenoxy)quinazoline-2,4-diamine, 2a
- 215925-70-5
- CHEMBL82334
- DB-292230
-
- Inchi： 1S/C15H14N4O/c1-9-5-7-10(8-6-9)20-12-4-2-3-11-13(12)14(16)19-15(17)18-11/h2-8H,1H3,(H4,16,17,18,19)
- InChI Key： BYDBBHVBHPKCHX-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C)=CC=1)C1=CC=CC2C1=C(N)N=C(N)N=2
Computed Properties
- Exact Mass: 266.11692
- Monoisotopic Mass: 266.11676108g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 319
- 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: 2.7
- Topological Polar Surface Area: 87?2
Experimental Properties
- PSA: 87.05
2,4-Quinazolinediamine, 5-(4-methylphenoxy)- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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