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88724-08-7 | Guanidine, [4-[2-(diethylamino)-1H-imidazol-4-yl]-2-thiazolyl]-
CAS No: 88724-08-7 Catalog No: AG0046KS MDL No:
Product Description
Catalog Number:
AG0046KS
Chemical Name:
Guanidine, [4-[2-(diethylamino)-1H-imidazol-4-yl]-2-thiazolyl]-
CAS Number:
88724-08-7
Molecular Formula:
C11H17N7S
Molecular Weight:
279.3646
IUPAC Name:
2-[4-[2-(diethylamino)-1H-imidazol-5-yl]-1,3-thiazol-2-yl]guanidine
InChI:
InChI=1S/C11H17N7S/c1-3-18(4-2)10-14-5-7(15-10)8-6-19-11(16-8)17-9(12)13/h5-6H,3-4H2,1-2H3,(H,14,15)(H4,12,13,16,17)
InChI Key:
ZVNIMRAFLWPJDM-UHFFFAOYSA-N
SMILES:
CCN(c1[nH]cc(n1)c1csc(n1)NC(=N)N)CC
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.127g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
279.366g/mol
Monoisotopic Mass:
279.127g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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