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831226-67-6 | 4-Quinazolinamine, N-[2-(4-morpholinyl)ethyl]-2-(2-pyridinyl)-
CAS No: 831226-67-6 Catalog No: AG005121 MDL No:
Product Description
Catalog Number:
AG005121
Chemical Name:
4-Quinazolinamine, N-[2-(4-morpholinyl)ethyl]-2-(2-pyridinyl)-
CAS Number:
831226-67-6
Molecular Formula:
C19H21N5O
Molecular Weight:
335.4029
IUPAC Name:
N-(2-morpholin-4-ylethyl)-2-pyridin-2-ylquinazolin-4-amine
InChI:
InChI=1S/C19H21N5O/c1-2-6-16-15(5-1)18(21-9-10-24-11-13-25-14-12-24)23-19(22-16)17-7-3-4-8-20-17/h1-8H,9-14H2,(H,21,22,23)
InChI Key:
APYNUQWABJIFAH-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)CCNc1nc(nc2c1cccc2)c1ccccn1
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.175g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.411g/mol
Monoisotopic Mass:
335.175g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
63.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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