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886497-59-2 | N-[4-(2,4,5-Trimethyl-phenyl)-thiazol-2-yl]-guanidine
CAS No: 886497-59-2 Catalog No: AG01F8DA MDL No:
Product Description
Catalog Number:
AG01F8DA
Chemical Name:
N-[4-(2,4,5-Trimethyl-phenyl)-thiazol-2-yl]-guanidine
CAS Number:
886497-59-2
Molecular Formula:
C13H16N4S
Molecular Weight:
260.3579
IUPAC Name:
2-[4-(2,4,5-trimethylphenyl)-1,3-thiazol-2-yl]guanidine
InChI:
InChI=1S/C13H16N4S/c1-7-4-9(3)10(5-8(7)2)11-6-18-13(16-11)17-12(14)15/h4-6H,1-3H3,(H4,14,15,16,17)
InChI Key:
WYAZKKQMPDLFTG-UHFFFAOYSA-N
SMILES:
NC(=N)Nc1scc(n1)c1cc(C)c(cc1C)C
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.11g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.359g/mol
Monoisotopic Mass:
260.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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