CAS
925672-86-2 Purity
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925672-86-2 Purity
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3-(4-(7-Chloroquinolin-4-yl)piperazin-1-yl)propanoic acid
CAS
925673-45-6
Catalog Number
ACM925673456
Category
Other Products
Molecular Formula
C16H18ClN3O2
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What is the molecular formula of the compound in PubChem CID 24873484?
The molecular formula is C16H18ClN3O2.
What is the molecular weight of the compound?
The molecular weight is 319.78 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]propanoic acid.
What is the Canonical SMILES of the compound?
The Canonical SMILES is C1CN(CCN1CCC(=O)O)C2=C3C=CC(=CC3=NC=C2)Cl.
What is the InChIKey of the compound?
The InChIKey is BIKUNRXBFMTWOH-UHFFFAOYSA-N.
What is the XLogP3 of the compound?
The XLogP3 is 0.1.
How many hydrogen bond donor counts are in the compound?
There is one hydrogen bond donor count in the compound.
What is the topological polar surface area of the compound?
The topological polar surface area is 56.7 Ų.
How many rotatable bond counts are there in the compound?
There are 4 rotatable bond counts in the compound.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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CAS
925674-54-0 Purity
96%
925674-54-0 Purity
96%
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