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248249-52-7 | Thiazole, 2-(1,3-benzodioxol-5-yl)-
CAS No: 248249-52-7 Catalog No: AG002PJZ MDL No:MFCD15146765
Product Description
Catalog Number:
AG002PJZ
Chemical Name:
Thiazole, 2-(1,3-benzodioxol-5-yl)-
CAS Number:
248249-52-7
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
MDL Number:
MFCD15146765
IUPAC Name:
2-(1,3-benzodioxol-5-yl)-1,3-thiazole
InChI:
InChI=1S/C10H7NO2S/c1-2-8-9(13-6-12-8)5-7(1)10-11-3-4-14-10/h1-5H,6H2
InChI Key:
VGRVWWKPZYSJTF-UHFFFAOYSA-N
SMILES:
c1csc(n1)c1ccc2c(c1)OCO2
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.231g/mol
Monoisotopic Mass:
205.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Anti-fibrotic effects of a methylenedioxybenzene compound, CW209292 on dimethylnitrosamine-induced hepatic fibrosis in rats. | Biological & pharmaceutical bulletin 20090801 |
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