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89151-00-8 | Quinazoline, 4-[4-(3-iodopropyl)-1-piperidinyl]-6,7-dimethoxy-
CAS No: 89151-00-8 Catalog No: AG003XHE MDL No:
Product Description
Catalog Number:
AG003XHE
Chemical Name:
Quinazoline, 4-[4-(3-iodopropyl)-1-piperidinyl]-6,7-dimethoxy-
CAS Number:
89151-00-8
Molecular Formula:
C18H24IN3O2
Molecular Weight:
441.3065
IUPAC Name:
4-[4-(3-iodopropyl)piperidin-1-yl]-6,7-dimethoxyquinazoline
InChI:
InChI=1S/C18H24IN3O2/c1-23-16-10-14-15(11-17(16)24-2)20-12-21-18(14)22-8-5-13(6-9-22)4-3-7-19/h10-13H,3-9H2,1-2H3
InChI Key:
SMCPWMIQZPRDLU-UHFFFAOYSA-N
SMILES:
ICCCC1CCN(CC1)c1ncnc2c1cc(OC)c(c2)OC
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
441.091g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
441.313g/mol
Monoisotopic Mass:
441.091g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
47.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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