CAS
951884-46-1 Purity
98%
951884-46-1 Purity
98%
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4-Chloro-6-(3-Methoxypropylamino)-2-methylthiopyrimidine
CAS
951884-56-3
Catalog Number
ACM951884563
Category
Other Products
Molecular Formula
C9H14ClN3OS
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What is the molecular formula of 4-Chloro-6-(3-Methoxypropylamino)-2-methylthiopyrimidine?
The molecular formula is C9H14ClN3OS.
What is the molecular weight of the compound?
The molecular weight is 247.75 g/mol.
When was the compound first created?
The compound was first created on May 28, 2009.
What is the IUPAC name of 4-Chloro-6-(3-Methoxypropylamino)-2-methylthiopyrimidine?
The IUPAC name is 6-chloro-N-(3-methoxypropyl)-2-methylsulfanylpyrimidin-4-amine.
What is the InChI for the compound?
The InChI is InChI=1S/C9H14ClN3OS/c1-14-5-3-4-11-8-6-7(10)12-9(13-8)15-2/h6H,3-5H2,1-2H3,(H,11,12,13).
What is the InChIKey for the compound?
The InChIKey is DTFIIZKQYAPLBY-UHFFFAOYSA-N.
What is the canonical SMILES for the compound?
The canonical SMILES is COCCCNC1=CC(=NC(=N1)SC)Cl.
What is the XLogP3-AA value for the compound?
The XLogP3-AA value is 2.5.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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