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89150-96-9

89150-96-9 | Quinazoline, 4-[4-(2-bromoethyl)-1-piperidinyl]-6,7-dimethoxy-

CAS No: 89150-96-9 Catalog No: AG003YS9 MDL No:

Product Description

Catalog Number:
AG003YS9
Chemical Name:
Quinazoline, 4-[4-(2-bromoethyl)-1-piperidinyl]-6,7-dimethoxy-
CAS Number:
89150-96-9
Molecular Formula:
C17H22BrN3O2
Molecular Weight:
380.2795
IUPAC Name:
4-[4-(2-bromoethyl)piperidin-1-yl]-6,7-dimethoxyquinazoline
InChI:
InChI=1S/C17H22BrN3O2/c1-22-15-9-13-14(10-16(15)23-2)19-11-20-17(13)21-7-4-12(3-6-18)5-8-21/h9-12H,3-8H2,1-2H3
InChI Key:
LKGULZXAEHURJD-UHFFFAOYSA-N
SMILES:
BrCCC1CCN(CC1)c1ncnc2c1cc(OC)c(c2)OC

Properties

Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
379.09g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
380.286g/mol
Monoisotopic Mass:
379.09g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
47.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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