hippuryl-L-histidyl-L-leucine
TL;DR: hippuryl-L-histidyl-L-leucine (CAS 31373-65-6) is a chemical compound with molecular formula C21H27N5O5 and molecular weight 429.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-2-[(2-benzamidoacetyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid
Also Known As: Hippuryl-His-Leu-OH, Hippuryl-histidyl-leucine, hippuryl-His-Leu, Hippuryl-L-histidyl-L-leucine, Hip-His-Leu
| Molecular Formula | C21H27N5O5 |
|---|---|
| Molecular Weight | 429.20 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 429.20123 |
| Heavy Atoms | 31 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 31373-65-6 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)O)NC(=O)[C@H](CC1=CN=CN1)NC(=O)CNC(=O)C2=CC=CC=C2 |
| InChIKey | AAXWBCKQYLBQKY-IRXDYDNUSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
hippuryl-L-histidyl-L-leucine (CAS 31373-65-6), with molecular formula C21H27N5O5 and molecular weight 429.20 g/mol. IUPAC: (2S)-2-[[(2S)-2-[(2-benzamidoacetyl)amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoic acid.
Chemical Property Profile of hippuryl-L-histidyl-L-leucine
Property Insights of hippuryl-L-histidyl-L-leucine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for hippuryl-L-histidyl-L-leucine. The TPSA of 153.0 Ų indicates high polarity, suggesting hippuryl-L-histidyl-L-leucine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, hippuryl-L-histidyl-L-leucine has 5 hydrogen bond donor(s) and 6 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 hippuryl-L-histidyl-L-leucine?
The CAS number of hippuryl-L-histidyl-L-leucine is 31373-65-6.
What is the molecular formula of hippuryl-L-histidyl-L-leucine?
The molecular formula of hippuryl-L-histidyl-L-leucine is C21H27N5O5.
What is the molecular weight of hippuryl-L-histidyl-L-leucine?
The molecular weight of hippuryl-L-histidyl-L-leucine is 429.20 g/mol.
Where can I buy hippuryl-L-histidyl-L-leucine?
You can request a quote for hippuryl-L-histidyl-L-leucine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hippuryl-L-histidyl-L-leucine?
Yes, KEHONG BIO provides custom synthesis services for hippuryl-L-histidyl-L-leucine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.