![(4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid structure](/static/products/106/106508-17-2.png)
(4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid
TL;DR: (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid (CAS 106508-17-2) is a chemical compound with molecular formula C28H29NO3 and molecular weight 427.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid
Also Known As: (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid, (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid, (E)-4-(2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrrol-3(2H)-ylidene)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid
| Molecular Formula | C28H29NO3 |
|---|---|
| Molecular Weight | 427.21 g/mol |
| LogP | 5.2335 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.21475 |
| Heavy Atoms | 32 |
| Complexity | 1155.2626 |
Chemical Identifiers
| CAS Number | 106508-17-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2)C3=C/C(=C(/CCC(=O)O)\C4=CC5=C(CCCC5)C=C4)/C(=O)N3 |
Product Overview
(4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid (CAS 106508-17-2), with molecular formula C28H29NO3 and molecular weight 427.21 g/mol. IUPAC: (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid.
Chemical Property Profile of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid
Property Insights of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid
The XLogP value of 5.2335 indicates that (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid. Following Lipinski's Rule of Five, (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid?
The CAS number of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid is 106508-17-2.
What is the molecular formula of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid?
The molecular formula of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid is C28H29NO3.
What is the molecular weight of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid?
The molecular weight of (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid is 427.21 g/mol.
Where can I buy (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid?
You can request a quote for (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[2-oxo-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-dihydro-3H-pyrrol-3-ylidene]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.