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365542-39-8

365542-39-8 | 4-[2-[4-[2-methoxy-5-[2-(4-pyridyl)ethyl]phenoxy]phenyl]ethyl]pyridine hydrochloride

CAS No: 365542-39-8 Catalog No: AG00JS69 MDL No:MFCD12546828

Product Description

Catalog Number:
AG00JS69
Chemical Name:
4-[2-[4-[2-methoxy-5-[2-(4-pyridyl)ethyl]phenoxy]phenyl]ethyl]pyridine hydrochloride
CAS Number:
365542-39-8
Molecular Formula:
C27H27ClN2O2
Molecular Weight:
446.9685
MDL Number:
MFCD12546828
IUPAC Name:
4-[2-[4-[2-methoxy-5-(2-pyridin-4-ylethyl)phenoxy]phenyl]ethyl]pyridine;hydrochloride
InChI:
InChI=1S/C27H26N2O2.ClH/c1-30-26-11-8-24(5-4-23-14-18-29-19-15-23)20-27(26)31-25-9-6-21(7-10-25)2-3-22-12-16-28-17-13-22;/h6-20H,2-5H2,1H3;1H
InChI Key:
VFCAGAFVCMLTSQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Oc1ccc(cc1)CCc1ccncc1)CCc1ccncc1.Cl

Properties

Complexity:
482  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.176g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
446.975g/mol
Monoisotopic Mass:
446.176g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
44.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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