(R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide
TL;DR: (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide (CAS 156127-64-9) is a chemical compound with molecular formula C16H31N5O3 and molecular weight 341.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-N-[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]-1-[(2S)-2,6-diaminohexanoyl]pyrrolidine-2-carboxamide
Also Known As: (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide, (2R)-N-[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]-1-[(2S)-2,6-diaminohexanoyl]pyrrolidine-2-carboxamide, (2S)-N-[(1S)-1-carbamoyl-2-methyl-propyl]-1-[(2S)-2,6-diaminohexanoyl]pyrrolidine-2-carboxamide
| Molecular Formula | C16H31N5O3 |
|---|---|
| Molecular Weight | 341.24 g/mol |
| LogP | -0.9402 |
| Topological Polar Surface Area | 144.54 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 341.24268 |
| Heavy Atoms | 24 |
| Complexity | 454.99384 |
Chemical Identifiers
| CAS Number | 156127-64-9 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)N)NC(=O)[C@H]1CCCN1C(=O)[C@H](CCCCN)N |
Product Overview
(R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide (CAS 156127-64-9), with molecular formula C16H31N5O3 and molecular weight 341.24 g/mol. IUPAC: (2R)-N-[(2S)-1-amino-3-methyl-1-oxobutan-2-yl]-1-[(2S)-2,6-diaminohexanoyl]pyrrolidine-2-carboxamide.
Chemical Property Profile of (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide
Property Insights of (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide
The XLogP value of -0.9402 indicates that (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.54 Ų indicates high polarity, suggesting (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide has 4 hydrogen bond donor(s) and 5 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 (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide?
The CAS number of (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide is 156127-64-9.
What is the molecular formula of (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide?
The molecular formula of (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide is C16H31N5O3.
What is the molecular weight of (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide?
The molecular weight of (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide is 341.24 g/mol.
Where can I buy (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide?
You can request a quote for (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for (R)-N-((S)-1-Amino-3-methyl-1-oxobutan-2-yl)-1-((S)-2,6-diaminohexanoyl)pyrrolidine-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.