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1086398-47-1 | N-[3-(6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-propyl]-guanidine
CAS No: 1086398-47-1 Catalog No: AG01F4GB MDL No:
Product Description
Catalog Number:
AG01F4GB
Chemical Name:
N-[3-(6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-propyl]-guanidine
CAS Number:
1086398-47-1
Molecular Formula:
C15H24N4O2
Molecular Weight:
292.3767
IUPAC Name:
2-[3-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)propyl]guanidine
InChI:
InChI=1S/C15H24N4O2/c1-20-13-8-10-5-7-18-12(4-3-6-19-15(16)17)11(10)9-14(13)21-2/h8-9,12,18H,3-7H2,1-2H3,(H4,16,17,19)
InChI Key:
FRROOMGFBCWJRP-UHFFFAOYSA-N
SMILES:
COc1cc2C(CCCNC(=N)N)NCCc2cc1OC
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.19g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
292.383g/mol
Monoisotopic Mass:
292.19g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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