Probestin
TL;DR: Probestin (CAS 123652-87-9) is a chemical compound with molecular formula C26H38N4O6 and molecular weight 502.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-[(2S)-1-[(2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
Also Known As: Probestin, 3-amino-2-hydroxy-4-phenylbutanoyl-leucyl-prolyl-proline, 1-(1-(N-(3-Amino-2-hydroxy-1-oxo-4-phenylbutyl)leucyl)prolyl)proline, (2S)-1-[(2S)-1-[(2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid, L-Proline, 1-(1-(N-(3-amino-2-hydroxy-1-oxo-4-phenylbutyl)-L-leucyl)-L-prolyl)-, (S-(R*,S*))-
| Molecular Formula | C26H38N4O6 |
|---|---|
| Molecular Weight | 502.28 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 502.27914 |
| Heavy Atoms | 36 |
| Complexity | 799.0 |
Chemical Identifiers
| CAS Number | 123652-87-9 |
|---|---|
| SMILES | CC(C)C[C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)O)NC(=O)[C@H]([C@@H](CC3=CC=CC=C3)N)O |
| InChIKey | CEQMEILRVSCKGT-FXTUREPZSA-N |
Product Overview
Probestin (CAS 123652-87-9), with molecular formula C26H38N4O6 and molecular weight 502.28 g/mol. IUPAC: (2S)-1-[(2S)-1-[(2S)-2-[[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of Probestin
Property Insights of Probestin
The XLogP value of -0.9 indicates that Probestin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 153.0 Ų indicates high polarity, suggesting Probestin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Probestin has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Probestin?
The CAS number of Probestin is 123652-87-9.
What is the molecular formula of Probestin?
The molecular formula of Probestin is C26H38N4O6.
What is the molecular weight of Probestin?
The molecular weight of Probestin is 502.28 g/mol.
Where can I buy Probestin?
You can request a quote for Probestin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Probestin?
Yes, KEHONG BIO provides custom synthesis services for Probestin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.