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124427-65-2

124427-65-2 | 4-Quinazolinamine, N-[2-(3-phenoxyphenyl)ethyl]-

CAS No: 124427-65-2 Catalog No: AG000M03 MDL No:

Product Description

Catalog Number:
AG000M03
Chemical Name:
4-Quinazolinamine, N-[2-(3-phenoxyphenyl)ethyl]-
CAS Number:
124427-65-2
Molecular Formula:
C22H19N3O
Molecular Weight:
341.4058
IUPAC Name:
N-[2-(3-phenoxyphenyl)ethyl]quinazolin-4-amine
InChI:
InChI=1S/C22H19N3O/c1-2-8-18(9-3-1)26-19-10-6-7-17(15-19)13-14-23-22-20-11-4-5-12-21(20)24-16-25-22/h1-12,15-16H,13-14H2,(H,23,24,25)
InChI Key:
CMVUZTOUJSFFNK-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Oc1cccc(c1)CCNc1ncnc2c1cccc2

Properties

Complexity:
412  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.153g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
341.414g/mol
Monoisotopic Mass:
341.153g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9  

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