CAS
93754-63-3 Purity
96%
93754-63-3 Purity
96%
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4-Demethyl tranilast
CAS
93755-77-2
Catalog Number
ACM93755772
Category
Other Products
Molecular Weight
313.30
Molecular Formula
C17H15NO5
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Specification
Synonyms
2-[[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]amino]benzoic Acid; (E)-2-[[3-(4-Hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]amino]benzoic Acid; Avenanthramide 1f; Avenanthramide E;
IUPAC Name
2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]benzoic acid
Canonical SMILES
COC1=C(C=CC(=C1)C=CC(=O)NC2=CC=CC=C2C(=O)O)O
InChI Key
FSKJPXSYWQUVGO-VQHVLOKHSA-N
Exact Mass
313.09500
H-Bond Acceptor
5
H-Bond Donor
3
What is the molecular formula of 4-Demethyl tranilast?
The molecular formula of 4-Demethyl tranilast is C17H15NO5.
What is the molecular weight of 4-Demethyl tranilast?
The molecular weight of 4-Demethyl tranilast is 313.30 g/mol.
What is another name for 4-Demethyl tranilast?
4-Demethyl tranilast is also known as Avenanthramide E.
What is the IUPAC name of 4-Demethyl tranilast?
The IUPAC name of 4-Demethyl tranilast is 2-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]benzoic acid.
What is the InChIKey of 4-Demethyl tranilast?
The InChIKey of 4-Demethyl tranilast is FSKJPXSYWQUVGO-VQHVLOKHSA-N.
What is the canonical SMILES of 4-Demethyl tranilast?
The canonical SMILES of 4-Demethyl tranilast is COC1=C(C=CC(=C1)C=CC(=O)NC2=CC=CC=C2C(=O)O).
What is the XLogP3-AA value of 4-Demethyl tranilast?
The XLogP3-AA value of 4-Demethyl tranilast is 2.9.
How many hydrogen bond donor counts does 4-Demethyl tranilast have?
4-Demethyl tranilast has 3 hydrogen bond donor counts.
What is the exact mass of 4-Demethyl tranilast?
The exact mass of 4-Demethyl tranilast is 313.09502258 g/mol.
How many rotatable bond counts does 4-Demethyl tranilast have?
4-Demethyl tranilast has 5 rotatable bond counts.
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