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Home > Thiazole > 1421509-45-6
1421509-45-6 | 1-(4,7-Dimethylbenzo[d]thiazol-2-yl)azetidin-3-ol
CAS No: 1421509-45-6 Catalog No: AG01AS2P MDL No:MFCD22587778
Product Description
Catalog Number:
AG01AS2P
Chemical Name:
1-(4,7-Dimethylbenzo[d]thiazol-2-yl)azetidin-3-ol
CAS Number:
1421509-45-6
Molecular Formula:
C12H14N2OS
Molecular Weight:
234.3174
MDL Number:
MFCD22587778
IUPAC Name:
1-(4,7-dimethyl-1,3-benzothiazol-2-yl)azetidin-3-ol
InChI:
InChI=1S/C12H14N2OS/c1-7-3-4-8(2)11-10(7)13-12(16-11)14-5-9(15)6-14/h3-4,9,15H,5-6H2,1-2H3
InChI Key:
XGNSQUFSFJXBLS-UHFFFAOYSA-N
SMILES:
OC1CN(C1)c1nc2c(s1)c(C)ccc2C
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.083g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
234.317g/mol
Monoisotopic Mass:
234.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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