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6637-36-1 | 4-(3,4-dihydroquinolin-1(2h)-yl)quinazoline
CAS No: 6637-36-1 Catalog No: AG006MSK MDL No:
Product Description
Catalog Number:
AG006MSK
Chemical Name:
4-(3,4-dihydroquinolin-1(2h)-yl)quinazoline
CAS Number:
6637-36-1
Molecular Formula:
C17H15N3
Molecular Weight:
261.3211
IUPAC Name:
4-(3,4-dihydro-2H-quinolin-1-yl)quinazoline
InChI:
InChI=1S/C17H15N3/c1-4-10-16-13(6-1)7-5-11-20(16)17-14-8-2-3-9-15(14)18-12-19-17/h1-4,6,8-10,12H,5,7,11H2
InChI Key:
NVOKTPNLFPWRFT-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)CCCN2c1ncnc2c1cccc2
NSC Number:
52102
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.127g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.328g/mol
Monoisotopic Mass:
261.127g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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