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318234-44-5 | 2-phenyl-5-(1H-pyrazol-3-yl)-1,3-thiazole
CAS No: 318234-44-5 Catalog No: AG00IST6 MDL No:MFCD00974300
Product Description
Catalog Number:
AG00IST6
Chemical Name:
2-phenyl-5-(1H-pyrazol-3-yl)-1,3-thiazole
CAS Number:
318234-44-5
Molecular Formula:
C12H9N3S
Molecular Weight:
227.2850
MDL Number:
MFCD00974300
IUPAC Name:
2-phenyl-5-(1H-pyrazol-5-yl)-1,3-thiazole
InChI:
InChI=1S/C12H9N3S/c1-2-4-9(5-3-1)12-13-8-11(16-12)10-6-7-14-15-10/h1-8H,(H,14,15)
InChI Key:
NRAHRUHGPGBWSI-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1ncc(s1)c1n[nH]cc1
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.052g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.285g/mol
Monoisotopic Mass:
227.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Development and characterization of new inhibitors of the human and mouse hematopoietic prostaglandin D(2) synthases. | Journal of medicinal chemistry 20100812 |
| 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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