Phthaloyl-L-isoleucine
TL;DR: Phthaloyl-L-isoleucine (CAS 21844-63-3) is a chemical compound with molecular formula C14H15NO4 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S)-2-(1,3-dioxoisoindol-2-yl)-3-methylpentanoic acid
Also Known As: Phthaloyl-L-isoleucine, PHT-ILE-OH, Pht-lle-OH, Pht-Ile, Pht-L-Ile-OH
| Molecular Formula | C14H15NO4 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.1001 |
| Heavy Atoms | 19 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 21844-63-3 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)O)N1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | RUUWUOYPIXTMLF-KWQFWETISA-N |
Product Overview
Phthaloyl-L-isoleucine (CAS 21844-63-3), with molecular formula C14H15NO4 and molecular weight 261.10 g/mol. IUPAC: (2S,3S)-2-(1,3-dioxoisoindol-2-yl)-3-methylpentanoic acid.
Chemical Property Profile of Phthaloyl-L-isoleucine
Property Insights of Phthaloyl-L-isoleucine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phthaloyl-L-isoleucine. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Phthaloyl-L-isoleucine. Following Lipinski's Rule of Five, Phthaloyl-L-isoleucine has 1 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 Phthaloyl-L-isoleucine?
The CAS number of Phthaloyl-L-isoleucine is 21844-63-3.
What is the molecular formula of Phthaloyl-L-isoleucine?
The molecular formula of Phthaloyl-L-isoleucine is C14H15NO4.
What is the molecular weight of Phthaloyl-L-isoleucine?
The molecular weight of Phthaloyl-L-isoleucine is 261.10 g/mol.
Where can I buy Phthaloyl-L-isoleucine?
You can request a quote for Phthaloyl-L-isoleucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phthaloyl-L-isoleucine?
Yes, KEHONG BIO provides custom synthesis services for Phthaloyl-L-isoleucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.