(2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)
TL;DR: (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) (CAS 1173684-99-5) is a chemical compound with molecular formula C16H28N4O6 and molecular weight 372.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[4-[[(1S)-1-carboxy-2-methylpropyl]carbamoyl]piperazine-1-carbonyl]amino]-3-methylbutanoic acid
Also Known As: (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid), (2S)-2-[[4-[[(2S)-1-hydroxy-3-methyl-1-oxobutan-2-yl]carbamoyl]piperazine-1-carbonyl]amino]-3-methylbutanoic acid, (2S,2'S)-2,2'-[piperazine-1,4-diylbis(carbonylimino)]bis(3-methylbutanoic acid) (non-preferred name)
| Molecular Formula | C16H28N4O6 |
|---|---|
| Molecular Weight | 372.20 g/mol |
| LogP | 0.2416 |
| Topological Polar Surface Area | 139.28 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.2009 |
| Heavy Atoms | 26 |
| Complexity | 494.85806 |
Chemical Identifiers
| CAS Number | 1173684-99-5 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O)NC(=O)N1CCN(CC1)C(=O)N[C@@H](C(C)C)C(=O)O |
Product Overview
(2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) (CAS 1173684-99-5), with molecular formula C16H28N4O6 and molecular weight 372.20 g/mol. IUPAC: (2S)-2-[[4-[[(1S)-1-carboxy-2-methylpropyl]carbamoyl]piperazine-1-carbonyl]amino]-3-methylbutanoic acid.
Chemical Property Profile of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)
Property Insights of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)
The XLogP value of 0.2416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid). The TPSA of 139.28 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid). Following Lipinski's Rule of Five, (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)?
The CAS number of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) is 1173684-99-5.
What is the molecular formula of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)?
The molecular formula of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) is C16H28N4O6.
What is the molecular weight of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)?
The molecular weight of (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) is 372.20 g/mol.
Where can I buy (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)?
You can request a quote for (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid)?
Yes, KEHONG BIO provides custom synthesis services for (2S,2'S)-2,2'-((piperazine-1,4-dicarbonyl)bis(azanediyl))bis(3-methylbutanoic acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.