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860785-61-1 | 2-[(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-ol
CAS No: 860785-61-1 Catalog No: AG00IWO6 MDL No:MFCD04124537
Product Description
Catalog Number:
AG00IWO6
Chemical Name:
2-[(4-{[1,1'-biphenyl]-4-yl}-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-ol
CAS Number:
860785-61-1
Molecular Formula:
C19H14N2OS2
Molecular Weight:
350.4573
MDL Number:
MFCD04124537
IUPAC Name:
2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]methyl]-1,3-thiazol-4-ol
InChI:
InChI=1S/C19H14N2OS2/c22-17-12-24-19(21-17)10-18-20-16(11-23-18)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,11-12,22H,10H2
InChI Key:
QOOSZVJRQSFDSU-UHFFFAOYSA-N
SMILES:
Oc1csc(n1)Cc1scc(n1)c1ccc(cc1)c1ccccc1
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.055g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.454g/mol
Monoisotopic Mass:
350.055g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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