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Bioymifi

CAS No.:
1420071-30-2
Catalog Number:
AG001HJG
Molecular Formula:
C22H12BrN3O4S
Molecular Weight:
494.3174
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥95%
1 week
United States
$91
- +
5mg
98%
1 week
United States
$165
- +
10mg
98%
1 week
United States
$232
- +
25mg
98%
1 week
United States
$407
- +
50mg
98%
1 week
United States
$690
- +
100mg
98%
1 week
United States
$1173
- +
Product Description
Catalog Number:
AG001HJG
Chemical Name:
Bioymifi
CAS Number:
1420071-30-2
Molecular Formula:
C22H12BrN3O4S
Molecular Weight:
494.3174
MDL Number:
MFCD28118988
IUPAC Name:
5-[5-[(Z)-[3-(4-bromophenyl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]isoindole-1,3-dione
InChI:
InChI=1S/C22H12BrN3O4S/c23-12-2-4-13(5-3-12)26-21(29)18(31-22(26)24)10-14-6-8-17(30-14)11-1-7-15-16(9-11)20(28)25-19(15)27/h1-10,24H,(H,25,27,28)/b18-10-,24-22?
InChI Key:
ULBOWKXOFOTCMU-NLDKGBHCSA-N
SMILES:
Brc1ccc(cc1)N1C(=N)S/C(=C\c2ccc(o2)c2ccc3c(c2)C(=O)NC3=O)/C1=O
Properties
Complexity:
841  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
492.973g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
494.319g/mol
Monoisotopic Mass:
492.973g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties