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89482-27-9 | Glycine,N-(1,4,5,6-tetrahydro-4,6-dithioxo-1,3,5-triazin-2-yl)- (9CI)
CAS No: 89482-27-9 Catalog No: AG0042DY MDL No:
Product Description
Catalog Number:
AG0042DY
Chemical Name:
Glycine,N-(1,4,5,6-tetrahydro-4,6-dithioxo-1,3,5-triazin-2-yl)- (9CI)
CAS Number:
89482-27-9
Molecular Formula:
C5H6N4O2S2
Molecular Weight:
218.2567
IUPAC Name:
2-[[4,6-bis(sulfanylidene)-1H-1,3,5-triazin-2-yl]amino]acetic acid
InChI:
InChI=1S/C5H6N4O2S2/c10-2(11)1-6-3-7-4(12)9-5(13)8-3/h1H2,(H,10,11)(H3,6,7,8,9,12,13)
InChI Key:
JCMKAZJKWVLFMY-UHFFFAOYSA-N
SMILES:
OC(=O)CNc1nc(=S)[nH]c(=S)[nH]1
EC Number:
289-505-7
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.993g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
218.249g/mol
Monoisotopic Mass:
217.993g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
150A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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