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114246-51-4

114246-51-4 | Benzenamine, 4-(4-phenoxy-2-quinazolinyl)-N,N-dipropyl-

CAS No: 114246-51-4 Catalog No: AG000AWQ MDL No:

Product Description

Catalog Number:
AG000AWQ
Chemical Name:
Benzenamine, 4-(4-phenoxy-2-quinazolinyl)-N,N-dipropyl-
CAS Number:
114246-51-4
Molecular Formula:
C26H27N3O
Molecular Weight:
397.5121
IUPAC Name:
4-(4-phenoxyquinazolin-2-yl)-N,N-dipropylaniline
InChI:
InChI=1S/C26H27N3O/c1-3-18-29(19-4-2)21-16-14-20(15-17-21)25-27-24-13-9-8-12-23(24)26(28-25)30-22-10-6-5-7-11-22/h5-17H,3-4,18-19H2,1-2H3
InChI Key:
PYVODWICWWXUSF-UHFFFAOYSA-N
SMILES:
CCCN(c1ccc(cc1)c1nc(Oc2ccccc2)c2c(n1)cccc2)CCC

Properties

Complexity:
481  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
397.215g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
397.522g/mol
Monoisotopic Mass:
397.215g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3  

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