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Home > Bromides > 1449218-23-8
1449218-23-8 | 4-Thiazolecarboxamide, 2-bromo-N-(phenylmethyl)-
CAS No: 1449218-23-8 Catalog No: AG001KD5 MDL No:
Product Description
Catalog Number:
AG001KD5
Chemical Name:
4-Thiazolecarboxamide, 2-bromo-N-(phenylmethyl)-
CAS Number:
1449218-23-8
Molecular Formula:
C11H9BrN2OS
Molecular Weight:
297.1710
IUPAC Name:
N-benzyl-2-bromo-1,3-thiazole-4-carboxamide
InChI:
InChI=1S/C11H9BrN2OS/c12-11-14-9(7-16-11)10(15)13-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,15)
InChI Key:
OLRVWSKLVHMCOJ-UHFFFAOYSA-N
SMILES:
Brc1scc(n1)C(=O)NCc1ccccc1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.962g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.17g/mol
Monoisotopic Mass:
295.962g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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