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1087792-52-6 | N-[2-(3-methylphenoxy)ethyl]-1H-imidazole-1-carboxamide
CAS No: 1087792-52-6 Catalog No: AG019N2B MDL No:MFCD11505388
Product Description
Catalog Number:
AG019N2B
Chemical Name:
N-[2-(3-methylphenoxy)ethyl]-1H-imidazole-1-carboxamide
CAS Number:
1087792-52-6
Molecular Formula:
C13H15N3O2
Molecular Weight:
245.2771
MDL Number:
MFCD11505388
IUPAC Name:
N-[2-(3-methylphenoxy)ethyl]imidazole-1-carboxamide
InChI:
InChI=1S/C13H15N3O2/c1-11-3-2-4-12(9-11)18-8-6-15-13(17)16-7-5-14-10-16/h2-5,7,9-10H,6,8H2,1H3,(H,15,17)
InChI Key:
GOQWSTHKJNXWJE-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)OCCNC(=O)n1cncc1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.116g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.282g/mol
Monoisotopic Mass:
245.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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