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70249-42-2 | 2-Thiazolidinone, 3,3'-(1,4-butanediyl)bis[4-thioxo-
CAS No: 70249-42-2 Catalog No: AG005WP4 MDL No:
Product Description
Catalog Number:
AG005WP4
Chemical Name:
2-Thiazolidinone, 3,3'-(1,4-butanediyl)bis[4-thioxo-
CAS Number:
70249-42-2
Molecular Formula:
C10H12N2O2S4
Molecular Weight:
320.4745
IUPAC Name:
3-[4-(2-oxo-4-sulfanylidene-1,3-thiazolidin-3-yl)butyl]-4-sulfanylidene-1,3-thiazolidin-2-one
InChI:
InChI=1S/C10H12N2O2S4/c13-9-11(7(15)5-17-9)3-1-2-4-12-8(16)6-18-10(12)14/h1-6H2
InChI Key:
WITUVOITZVSKSQ-UHFFFAOYSA-N
SMILES:
S=C1CSC(=O)N1CCCCN1C(=O)SCC1=S
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.978g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
320.458g/mol
Monoisotopic Mass:
319.978g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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