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121845-94-1

121845-94-1 | 1,2,4-Triazino[5,6-c]quinoline, 3,4-dihydro-3,3-dimethyl-

CAS No: 121845-94-1 Catalog No: AG00165I MDL No:

Product Description

Catalog Number:
AG00165I
Chemical Name:
1,2,4-Triazino[5,6-c]quinoline, 3,4-dihydro-3,3-dimethyl-
CAS Number:
121845-94-1
Molecular Formula:
C12H12N4
Molecular Weight:
212.2505
IUPAC Name:
3,3-dimethyl-4H-[1,2,4]triazino[5,6-c]quinoline
InChI:
InChI=1S/C12H12N4/c1-12(2)14-10-7-13-9-6-4-3-5-8(9)11(10)15-16-12/h3-7,14H,1-2H3
InChI Key:
BJDADNMWQXQSAI-UHFFFAOYSA-N
SMILES:
CC1(C)N=Nc2c(N1)cnc1c2cccc1

Properties

Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.106g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
212.256g/mol
Monoisotopic Mass:
212.106g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

Literature

Title Journal
Pyrido[3,4-e]-1,2,4-triazines and related heterocycles as potential antifungal agents. Journal of medicinal chemistry 19891101

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