CAS
910297-57-3 Purity
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910297-57-3 Purity
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Hydroxy vandetanib
CAS
910298-61-2
Catalog Number
ACM910298612
Category
Other Products
Molecular Weight
491.35
Molecular Formula
C22H24BrFN4O3
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Specification
Synonyms
4-[[[4-[(4-Bromo-2-fluorophenyl)amino]-6-methoxy-7-quinazolinyl]oxy]methyl]-1-piperidinemethanol;
IUPAC Name
[4-[[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxymethyl]piperidin-1-yl]methanol
InChI Key
DOKXHMPUAQBETB-UHFFFAOYSA-N
Exact Mass
490.10200
H-Bond Acceptor
8
H-Bond Donor
2
What is the molecular formula of Hydroxy Vandetanib?
The molecular formula of Hydroxy Vandetanib is C22H24BrFN4O3.
What are the synonyms for Hydroxy Vandetanib?
The synonyms for Hydroxy Vandetanib are "910298-61-2" and "[4-[[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxymethyl]piperidin-1-yl]methanol".
What is the molecular weight of Hydroxy Vandetanib?
The molecular weight of Hydroxy Vandetanib is 491.4 g/mol.
What is the IUPAC name of Hydroxy Vandetanib?
The IUPAC name of Hydroxy Vandetanib is [4-[[4-(4-bromo-2-fluoroanilino)-6-methoxyquinazolin-7-yl]oxymethyl]piperidin-1-yl]methanol.
What is the InChI of Hydroxy Vandetanib?
The InChI of Hydroxy Vandetanib is InChI=1S/C22H24BrFN4O3/c1-30-20-9-16-19(10-21(20)31-11-14-4-6-28(13-29)7-5-14)25-12-26-22(16)27-18-3-2-15(23)8-17(18)24/h2-3,8-10,12,14,29H,4-7,11,13H2,1H3,(H,25,26,27).
What is the InChIKey of Hydroxy Vandetanib?
The InChIKey of Hydroxy Vandetanib is DOKXHMPUAQBETB-UHFFFAOYSA-N.
What is the canonical SMILES of Hydroxy Vandetanib?
The canonical SMILES of Hydroxy Vandetanib is COC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Br)F)OCC4CCN(CC4)CO.
What is the CAS number of Hydroxy Vandetanib?
The CAS number of Hydroxy Vandetanib is 910298-61-2.
What is the XLogP3-AA value of Hydroxy Vandetanib?
The XLogP3-AA value of Hydroxy Vandetanib is 4.3.
Is Hydroxy Vandetanib canonicalized?
Yes, Hydroxy Vandetanib is canonicalized.
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