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4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid structure
Fine Chemical

4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid

TL;DR: 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid (CAS 1396967-96-6) is a chemical compound with molecular formula C16H28N2O5 and molecular weight 328.19983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-methyl-2-[[4-methyl-2-(3-oxobutanoylamino)pentanoyl]amino]pentanoic acid

Also Known As: 4-methyl-2-[[4-methyl-2-(3-oxobutanoylamino)pentanoyl]amino]pentanoic Acid, 4-methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid

CAS Number
1396967-96-6
Molecular Formula
C16H28N2O5
Molecular Weight
328.19983 g/mol
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Technical Specifications

Molecular FormulaC16H28N2O5
Molecular Weight328.19983 g/mol
XLogP0.4
Topological Polar Surface Area (TPSA)113.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds10
Exact Mass328.19983 Da
Heavy Atoms23
Complexity446.0
SMILESCC(C)CC(C(=O)NC(CC(C)C)C(=O)O)NC(=O)CC(=O)C
InChIKeyTYISSGFGUZUDKJ-UHFFFAOYSA-N

Chemical Property Profile of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid

XLogP
0.4
TPSA (Topological Polar Surface Area)
113.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
10
Heavy Atoms
23
Complexity
446.0
Exact Mass
328.19983
Monoisotopic Mass
328.19983
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid

The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid. Following Lipinski's Rule of Five, 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid?

The CAS number of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid is 1396967-96-6.

What is the molecular formula of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid?

The molecular formula of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid is C16H28N2O5.

What is the molecular weight of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid?

The molecular weight of 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid is 328.19983 g/mol.

Where can I buy 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid?

You can request a quote for 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid?

Yes, CoreyChem provides custom synthesis services for 4-Methyl-2-[4-methyl-2-(3-oxobutanoylamino)pentanoylamino]pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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