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860651-56-5

860651-56-5 | 2-[(4-phenyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-ol

CAS No: 860651-56-5 Catalog No: AG00IWC8 MDL No:MFCD04124420

Product Description

Catalog Number:
AG00IWC8
Chemical Name:
2-[(4-phenyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-ol
CAS Number:
860651-56-5
Molecular Formula:
C13H10N2OS2
Molecular Weight:
274.3613
MDL Number:
MFCD04124420
IUPAC Name:
2-[(4-phenyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-ol
InChI:
InChI=1S/C13H10N2OS2/c16-11-8-18-13(15-11)6-12-14-10(7-17-12)9-4-2-1-3-5-9/h1-5,7-8,16H,6H2
InChI Key:
INERSTGRFNBJNM-UHFFFAOYSA-N
SMILES:
Oc1csc(n1)Cc1scc(n1)c1ccccc1

Properties

Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.023g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.356g/mol
Monoisotopic Mass:
274.023g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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