Home Other Building Blocks 5-(1,1-dioxo-1lambda6-thiolan-3-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione

5-(1,1-dioxo-1lambda6-thiolan-3-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione

CAS No.:
874593-97-2
Catalog Number:
AG019OUS
Molecular Formula:
C8H10N2O4S2
Molecular Weight:
262.3060
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Product Description
Catalog Number:
AG019OUS
Chemical Name:
5-(1,1-dioxo-1lambda6-thiolan-3-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
CAS Number:
874593-97-2
Molecular Formula:
C8H10N2O4S2
Molecular Weight:
262.3060
MDL Number:
MFCD07687982
IUPAC Name:
5-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione
InChI:
InChI=1S/C8H10N2O4S2/c11-6-5(7(12)10-8(15)9-6)4-1-2-16(13,14)3-4/h4-5H,1-3H2,(H2,9,10,11,12,15)
InChI Key:
ZZEKATLNQBNWOE-UHFFFAOYSA-N
SMILES:
S=C1NC(=O)C(C(=O)N1)C1CCS(=O)(=O)C1
Properties
Complexity:
445  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.008g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
262.298g/mol
Monoisotopic Mass:
262.008g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties