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457659-93-7

457659-93-7 | Piperazine, 1-(2-methoxyphenyl)-4-[3-(3-phenyl-5-isoxazolyl)propyl]-

CAS No: 457659-93-7 Catalog No: AG006YSR MDL No:

Product Description

Catalog Number:
AG006YSR
Chemical Name:
Piperazine, 1-(2-methoxyphenyl)-4-[3-(3-phenyl-5-isoxazolyl)propyl]-
CAS Number:
457659-93-7
Molecular Formula:
C23H27N3O2
Molecular Weight:
377.4794
IUPAC Name:
5-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-phenyl-1,2-oxazole
InChI:
InChI=1S/C23H27N3O2/c1-27-23-12-6-5-11-22(23)26-16-14-25(15-17-26)13-7-10-20-18-21(24-28-20)19-8-3-2-4-9-19/h2-6,8-9,11-12,18H,7,10,13-17H2,1H3
InChI Key:
ZNMYILNDKJBSJR-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CCN(CC1)CCCc1onc(c1)c1ccccc1

Properties

Complexity:
449  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.21g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
377.488g/mol
Monoisotopic Mass:
377.21g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
41.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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