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Home Other Building Blocks 1,3,5-Triazine-2,4-diamine,N2,N4-diethyl-6-hydrazinyl-

1,3,5-Triazine-2,4-diamine,N2,N4-diethyl-6-hydrazinyl-

CAS No.:
10421-98-4
Catalog Number:
AG00867W
Molecular Formula:
C7H15N7
Molecular Weight:
197.2409
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Product Description
Catalog Number:
AG00867W
Chemical Name:
1,3,5-Triazine-2,4-diamine,N2,N4-diethyl-6-hydrazinyl-
CAS Number:
10421-98-4
Molecular Formula:
C7H15N7
Molecular Weight:
197.2409
MDL Number:
MFCD03478313
IUPAC Name:
2-N,4-N-diethyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C7H15N7/c1-3-9-5-11-6(10-4-2)13-7(12-5)14-8/h3-4,8H2,1-2H3,(H3,9,10,11,12,13,14)
InChI Key:
BVGUQIRYCWKXNV-UHFFFAOYSA-N
SMILES:
CCNc1nc(NCC)nc(n1)NN
NSC Number:
99855
Properties
Complexity:
139  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.139g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
197.246g/mol
Monoisotopic Mass:
197.139g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties