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92616-17-6

92616-17-6 | N-(4-AMINO-6-(4-METHOXY-1-NAPHTHALENYL)-1,3,5-TRIAZIN-2-YL)NICOTINAMIDE

CAS No: 92616-17-6 Catalog No: AG006G1T MDL No:

Product Description

Catalog Number:
AG006G1T
Chemical Name:
N-(4-AMINO-6-(4-METHOXY-1-NAPHTHALENYL)-1,3,5-TRIAZIN-2-YL)NICOTINAMIDE
CAS Number:
92616-17-6
Molecular Formula:
C20H16N6O2
Molecular Weight:
372.3800
IUPAC Name:
N-[4-amino-6-(4-methoxynaphthalen-1-yl)-1,3,5-triazin-2-yl]pyridine-3-carboxamide
InChI:
InChI=1S/C20H16N6O2/c1-28-16-9-8-15(13-6-2-3-7-14(13)16)17-23-19(21)26-20(24-17)25-18(27)12-5-4-10-22-11-12/h2-11H,1H3,(H3,21,23,24,25,26,27)
InChI Key:
MZJQCVUBQNLANS-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1cccc2)c1nc(nc(n1)N)NC(=O)c1cccnc1

Properties

Complexity:
535  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.133g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
372.388g/mol
Monoisotopic Mass:
372.133g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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