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Home > Pyridines > 365542-40-1
365542-40-1 | 3-[2-[4-[2-methoxy-5-[2-(3-pyridyl)ethyl]phenoxy]phenyl]ethyl]pyridine
CAS No: 365542-40-1 Catalog No: AG00JS3P MDL No:MFCD12546738
Product Description
Catalog Number:
AG00JS3P
Chemical Name:
3-[2-[4-[2-methoxy-5-[2-(3-pyridyl)ethyl]phenoxy]phenyl]ethyl]pyridine
CAS Number:
365542-40-1
Molecular Formula:
C27H26N2O2
Molecular Weight:
410.5075
MDL Number:
MFCD12546738
IUPAC Name:
3-[2-[4-[2-methoxy-5-(2-pyridin-3-ylethyl)phenoxy]phenyl]ethyl]pyridine
InChI:
InChI=1S/C27H26N2O2/c1-30-26-15-12-22(7-9-24-5-3-17-29-20-24)18-27(26)31-25-13-10-21(11-14-25)6-8-23-4-2-16-28-19-23/h2-5,10-20H,6-9H2,1H3
InChI Key:
QVMZOCPEMFBHIF-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Oc1ccc(cc1)CCc1cccnc1)CCc1cccnc1
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.199g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
410.517g/mol
Monoisotopic Mass:
410.199g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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