Home Aminos 4-{[(isoquinolin-5-yl)methyl]amino}butan-1-ol

4-{[(isoquinolin-5-yl)methyl]amino}butan-1-ol

CAS No.:
1981888-22-5
Catalog Number:
AG01DW4X
Molecular Formula:
C14H18N2O
Molecular Weight:
230.3055
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DW4X
Chemical Name:
4-{[(isoquinolin-5-yl)methyl]amino}butan-1-ol
CAS Number:
1981888-22-5
Molecular Formula:
C14H18N2O
Molecular Weight:
230.3055
MDL Number:
MFCD31629392
IUPAC Name:
4-(isoquinolin-5-ylmethylamino)butan-1-ol
InChI:
InChI=1S/C14H18N2O/c17-9-2-1-7-15-10-12-4-3-5-13-11-16-8-6-14(12)13/h3-6,8,11,15,17H,1-2,7,9-10H2
InChI Key:
NYTLGHIBJPUMIA-UHFFFAOYSA-N
SMILES:
OCCCCNCc1cccc2c1ccnc2
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.142g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
230.311g/mol
Monoisotopic Mass:
230.142g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
45.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties