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Home > Aldehydes > 648449-13-2
648449-13-2 | 6-Quinazolinecarboxaldehyde, 4-[(2-pyridinylmethyl)amino]-
CAS No: 648449-13-2 Catalog No: AG006SSH MDL No:
Product Description
Catalog Number:
AG006SSH
Chemical Name:
6-Quinazolinecarboxaldehyde, 4-[(2-pyridinylmethyl)amino]-
CAS Number:
648449-13-2
Molecular Formula:
C15H12N4O
Molecular Weight:
264.2820
IUPAC Name:
4-(pyridin-2-ylmethylamino)quinazoline-6-carbaldehyde
InChI:
InChI=1S/C15H12N4O/c20-9-11-4-5-14-13(7-11)15(19-10-18-14)17-8-12-3-1-2-6-16-12/h1-7,9-10H,8H2,(H,17,18,19)
InChI Key:
XCYLQYCBWNBACQ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)c(ncn2)NCc1ccccn1
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.101g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.288g/mol
Monoisotopic Mass:
264.101g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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