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917566-98-4 | 2-Thiazolecarboxamide, 4-(2-furanyl)-N-(2-methylpropyl)-
CAS No: 917566-98-4 Catalog No: AG006DPU MDL No:
Product Description
Catalog Number:
AG006DPU
Chemical Name:
2-Thiazolecarboxamide, 4-(2-furanyl)-N-(2-methylpropyl)-
CAS Number:
917566-98-4
Molecular Formula:
C12H14N2O2S
Molecular Weight:
250.3168
IUPAC Name:
4-(furan-2-yl)-N-(2-methylpropyl)-1,3-thiazole-2-carboxamide
InChI:
InChI=1S/C12H14N2O2S/c1-8(2)6-13-11(15)12-14-9(7-17-12)10-4-3-5-16-10/h3-5,7-8H,6H2,1-2H3,(H,13,15)
InChI Key:
OKLAYZWNFFPJBO-UHFFFAOYSA-N
SMILES:
CC(CNC(=O)c1scc(n1)c1ccco1)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.078g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
250.316g/mol
Monoisotopic Mass:
250.078g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
83.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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