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Home > Thiazole > 1422136-03-5
1422136-03-5 | (2-((2-methylthiazol-4-yl)methyl)-2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-4-yl)methanol
CAS No: 1422136-03-5 Catalog No: AG01DI6T MDL No:
Product Description
Catalog Number:
AG01DI6T
Chemical Name:
(2-((2-methylthiazol-4-yl)methyl)-2,4,5,7-tetrahydropyrano[3,4-c]pyrazol-4-yl)methanol
CAS Number:
1422136-03-5
Molecular Formula:
C12H15N3O2S
Molecular Weight:
265.3314
IUPAC Name:
[2-[(2-methyl-1,3-thiazol-4-yl)methyl]-5,7-dihydro-4H-pyrano[3,4-c]pyrazol-4-yl]methanol
InChI:
InChI=1S/C12H15N3O2S/c1-8-13-10(7-18-8)2-15-3-11-9(4-16)5-17-6-12(11)14-15/h3,7,9,16H,2,4-6H2,1H3
InChI Key:
PEQMSAOWTHFVTH-UHFFFAOYSA-N
SMILES:
OCC1COCc2c1cn(n2)Cc1csc(n1)C
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.088g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.331g/mol
Monoisotopic Mass:
265.088g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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