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Home > Imidazoles > 115129-59-4
115129-59-4 | Guanidine, N-[2-(diphenylmethoxy)ethyl]-N'-[3-(1H-imidazol-5-yl)propyl]-
CAS No: 115129-59-4 Catalog No: AG000GB7 MDL No:
Product Description
Catalog Number:
AG000GB7
Chemical Name:
Guanidine, N-[2-(diphenylmethoxy)ethyl]-N'-[3-(1H-imidazol-5-yl)propyl]-
CAS Number:
115129-59-4
Molecular Formula:
C22H27N5O
Molecular Weight:
377.4827
IUPAC Name:
1-(2-benzhydryloxyethyl)-2-[3-(1H-imidazol-5-yl)propyl]guanidine
InChI:
InChI=1S/C22H27N5O/c23-22(25-13-7-12-20-16-24-17-27-20)26-14-15-28-21(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,16-17,21H,7,12-15H2,(H,24,27)(H3,23,25,26)
InChI Key:
HRKLSLHRTZOWMT-UHFFFAOYSA-N
SMILES:
N=C(NCCCc1cnc[nH]1)NCCOC(c1ccccc1)c1ccccc1
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.222g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
377.492g/mol
Monoisotopic Mass:
377.222g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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