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Home > Thiazole > 1254970-18-7
1254970-18-7 | 5-Thiazolecarboxamide, 2-chloro-N-(tetrahydro-2H-pyran-4-yl)-
CAS No: 1254970-18-7 Catalog No: AG000NQ4 MDL No:
Product Description
Catalog Number:
AG000NQ4
Chemical Name:
5-Thiazolecarboxamide, 2-chloro-N-(tetrahydro-2H-pyran-4-yl)-
CAS Number:
1254970-18-7
Molecular Formula:
C9H11ClN2O2S
Molecular Weight:
246.7138
IUPAC Name:
2-chloro-N-(oxan-4-yl)-1,3-thiazole-5-carboxamide
InChI:
InChI=1S/C9H11ClN2O2S/c10-9-11-5-7(15-9)8(13)12-6-1-3-14-4-2-6/h5-6H,1-4H2,(H,12,13)
InChI Key:
GYYGFQOBKKWSJB-UHFFFAOYSA-N
SMILES:
O=C(c1cnc(s1)Cl)NC1CCOCC1
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.023g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.709g/mol
Monoisotopic Mass:
246.023g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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