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101071-66-3 | 1,3,5-Triazin-2-amine, 4-(methylthio)-6-(1-piperidinyl)-
CAS No: 101071-66-3 Catalog No: AG0003N7 MDL No:MFCD00052771
Product Description
Catalog Number:
AG0003N7
Chemical Name:
1,3,5-Triazin-2-amine, 4-(methylthio)-6-(1-piperidinyl)-
CAS Number:
101071-66-3
Molecular Formula:
C9H15N5S
Molecular Weight:
225.3139
MDL Number:
MFCD00052771
IUPAC Name:
4-methylsulfanyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
InChI:
InChI=1S/C9H15N5S/c1-15-9-12-7(10)11-8(13-9)14-5-3-2-4-6-14/h2-6H2,1H3,(H2,10,11,12,13)
InChI Key:
YZOGJJYRAKOFKZ-UHFFFAOYSA-N
SMILES:
CSc1nc(N)nc(n1)N1CCCCC1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.105g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.314g/mol
Monoisotopic Mass:
225.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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