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(2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate structure
Fine Chemical

(2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate

TL;DR: (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate (CAS 145314-87-0) is a chemical compound with molecular formula C9H17N3O4 and molecular weight 231.1219 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate

Also Known As: (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate

CAS Number
145314-87-0
Molecular Formula
C9H17N3O4
Molecular Weight
231.1219 g/mol
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Technical Specifications

Molecular FormulaC9H17N3O4
Molecular Weight231.1219 g/mol
XLogP-3.1
Topological Polar Surface Area (TPSA)140.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass231.1219 Da
Heavy Atoms16
Complexity285.0
SMILESCC(C)[C@@H](C(=O)[O-])NC(=O)[C@H](CC(=O)N)[NH3+]
InChIKeyKWBQPGIYEZKDEG-FSPLSTOPSA-N

Chemical Property Profile of (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate

XLogP
-3.1
TPSA (Topological Polar Surface Area)
140.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
16
Complexity
285.0
Exact Mass
231.1219
Monoisotopic Mass
231.1219
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 (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate

The XLogP value of -3.1 indicates that (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate?

The CAS number of (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate is 145314-87-0.

What is the molecular formula of (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate?

The molecular formula of (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate is C9H17N3O4.

What is the molecular weight of (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate?

The molecular weight of (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate is 231.1219 g/mol.

Where can I buy (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate?

You can request a quote for (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate?

Yes, CoreyChem provides custom synthesis services for (2S)-2-[[(2S)-4-amino-2-azaniumyl-4-oxobutanoyl]amino]-3-methylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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