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124429-03-4 | Quinazoline, 4-[2-(4-butoxyphenyl)ethoxy]-
CAS No: 124429-03-4 Catalog No: AG000LZR MDL No:
Product Description
Catalog Number:
AG000LZR
Chemical Name:
Quinazoline, 4-[2-(4-butoxyphenyl)ethoxy]-
CAS Number:
124429-03-4
Molecular Formula:
C20H22N2O2
Molecular Weight:
322.4009
IUPAC Name:
4-[2-(4-butoxyphenyl)ethoxy]quinazoline
InChI:
InChI=1S/C20H22N2O2/c1-2-3-13-23-17-10-8-16(9-11-17)12-14-24-20-18-6-4-5-7-19(18)21-15-22-20/h4-11,15H,2-3,12-14H2,1H3
InChI Key:
KCNCAHUJDPRDKL-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)CCOc1ncnc2c1cccc2
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.168g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.408g/mol
Monoisotopic Mass:
322.168g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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