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7218-84-0 | N,N-DIMETHYL-6-[2-(4-PHENYLPIPERAZIN-1-YL)ETHYL]-1,3,5-TRIAZINE-2,4-DIAMINE
CAS No: 7218-84-0 Catalog No: AG005JGS MDL No:
Product Description
Catalog Number:
AG005JGS
Chemical Name:
N,N-DIMETHYL-6-[2-(4-PHENYLPIPERAZIN-1-YL)ETHYL]-1,3,5-TRIAZINE-2,4-DIAMINE
CAS Number:
7218-84-0
Molecular Formula:
C17H25N7
Molecular Weight:
327.4273
IUPAC Name:
2-N,2-N-dimethyl-6-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C17H25N7/c1-22(2)17-20-15(19-16(18)21-17)8-9-23-10-12-24(13-11-23)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H2,18,19,20,21)
InChI Key:
PTGDZCABUBRYIS-UHFFFAOYSA-N
SMILES:
Nc1nc(CCN2CCN(CC2)c2ccccc2)nc(n1)N(C)C
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.217g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.436g/mol
Monoisotopic Mass:
327.217g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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