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89258-81-1 | Methanimidamide, N-[4-(1H-imidazol-4-yl)-2-methoxyphenyl]-N'-propyl-
CAS No: 89258-81-1 Catalog No: AG0041RE MDL No:
Product Description
Catalog Number:
AG0041RE
Chemical Name:
Methanimidamide, N-[4-(1H-imidazol-4-yl)-2-methoxyphenyl]-N'-propyl-
CAS Number:
89258-81-1
Molecular Formula:
C14H18N4O
Molecular Weight:
258.3189
IUPAC Name:
N-[4-(1H-imidazol-5-yl)-2-methoxyphenyl]-N'-propylmethanimidamide
InChI:
InChI=1S/C14H18N4O/c1-3-6-15-9-17-12-5-4-11(7-14(12)19-2)13-8-16-10-18-13/h4-5,7-10H,3,6H2,1-2H3,(H,15,17)(H,16,18)
InChI Key:
IPESOOWHXUQRJQ-UHFFFAOYSA-N
SMILES:
CCCN=CNc1ccc(cc1OC)c1c[nH]cn1
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.148g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.325g/mol
Monoisotopic Mass:
258.148g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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