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Optovin

CAS No.:
348575-88-2
Catalog Number:
AG00C6JH
Molecular Formula:
C15H13N3OS2
Molecular Weight:
315.4132
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥98%
1 week
United States
$147
- +
10mg
≥98%
1 week
United States
$229
- +
25mg
≥98%
1 week
United States
$418
- +
50mg
≥98%
1 week
United States
$689
- +
100mg
99%
1 week
United States
$1123
- +
Product Description
Catalog Number:
AG00C6JH
Chemical Name:
Optovin
CAS Number:
348575-88-2
Molecular Formula:
C15H13N3OS2
Molecular Weight:
315.4132
MDL Number:
MFCD02219276
IUPAC Name:
(5E)-5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C15H13N3OS2/c1-9-6-11(7-13-14(19)17-15(20)21-13)10(2)18(9)12-4-3-5-16-8-12/h3-8H,1-2H3,(H,17,19,20)/b13-7+
InChI Key:
YISGMOZSGOGYOU-NTUHNPAUSA-N
SMILES:
S=C1NC(=O)/C(=C\c2cc(n(c2C)c2cccnc2)C)/S1
Properties
Complexity:
480  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
315.05g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
315.409g/mol
Monoisotopic Mass:
315.05g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties