![2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid structure](/static/products/4253/42538-01-2.webp)
2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid
TL;DR: 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid (CAS 42538-01-2) is a chemical compound with molecular formula C20H30N2O5 and molecular weight 378.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoic acid
Also Known As: Z-Ile-Ile, Z-Ile-Ile-OH, EINECS 255-876-9, N-(N-((Benzyloxy)carbonyl)-L-isoleucyl)-L-isoleucine, (2S,3S)-2-((2S,3S)-2-(((Benzyloxy)carbonyl)amino)-3-methylpentanamido)-3-methylpentanoic acid
| Molecular Formula | C20H30N2O5 |
|---|---|
| Molecular Weight | 378.22 g/mol |
| LogP | 2.943 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 378.21548 |
| Heavy Atoms | 27 |
| Complexity | 620.0579 |
Chemical Identifiers
| CAS Number | 42538-01-2 |
|---|---|
| SMILES | CCC(C)C(C(=O)NC(C(C)CC)C(=O)O)NC(=O)OCC1=CC=CC=C1 |
Product Overview
2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid (CAS 42538-01-2), with molecular formula C20H30N2O5 and molecular weight 378.22 g/mol. IUPAC: 3-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]pentanoic acid.
Chemical Property Profile of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid
Property Insights of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid
The XLogP value of 2.943 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid. Following Lipinski's Rule of Five, 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid 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
Frequently Asked Questions
What is the CAS number of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid?
The CAS number of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid is 42538-01-2.
What is the molecular formula of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid?
The molecular formula of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid is C20H30N2O5.
What is the molecular weight of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid?
The molecular weight of 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid is 378.22 g/mol.
Where can I buy 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid?
You can request a quote for 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-(Benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]-3-methyl-pentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.