Perhydroantamanide
TL;DR: Perhydroantamanide (CAS 33906-64-8) is a chemical compound with molecular formula C64H102N10O10 and molecular weight 1170.78 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-N-[(2S)-1-[(2S)-2-[(2S)-2,3-bis[(2S)-2-amino-3-cyclohexylpropanoyl]-3-[(2S)-1-[(2S)-1-[(2S)-2-amino-3-cyclohexylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]-4-[(2S)-2-aminopropanoyl]-2-formylpyrrolidine-1-carbonyl]-2,3-dihydropyrrol-1-yl]-3-methyl-1-oxobutan-2-yl]-3-cyclohexylpropanamide
Also Known As: Perhydroantamanide, Lithium perhydroantamanide complex, 2-hydroxycarbonylphenylhydrazine hydrochloride, (2S)-2-amino-N-[(2S)-1-[(2S)-2-[(2S)-2,3-bis[(2S)-2-amino-3-cyclohexylpropanoyl]-3-[(2S)-1-[(2S)-1-[(2S)-2-amino-3-cyclohexylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]-4-[(2S)-2-aminopropanoyl]-2-formylpyrrolidine-1-carbonyl]-2,3-dihydropyrrol-1-yl]-3-methyl-1-oxobutan-2-yl]-3-cyclohexylpropanamide, (2S)-N-((2S)-1-((2S)-2-((2S)-4-(L-alanyl)-2,3-bis((S)-2-amino-3-cyclohexylpropanoyl)-3-(((S)-2-amino-3-cyclohexylpropanoyl)-L-prolyl-L-prolyl)-2-formylpyrrolidine-1-carbonyl)-2,3-dihydro-1H-pyrrol-1-yl)-3-methyl-1-oxobutan-2-yl)-2-amino-3-cyclohexylpropanamide
| Molecular Formula | C64H102N10O10 |
|---|---|
| Molecular Weight | 1170.78 g/mol |
| LogP | 4.4207 |
| Topological Polar Surface Area | 325.79 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 24 |
| Exact Mass | 1170.7781 |
| Heavy Atoms | 84 |
| Complexity | 2429.7932 |
Chemical Identifiers
| CAS Number | 33906-64-8 |
|---|---|
| SMILES | C[C@@H](C(=O)C1CN([C@@](C1(C(=O)[C@@H]2CCCN2C(=O)[C@@H]3CCCN3C(=O)[C@H](CC4CCCCC4)N)C(=O)[C@H](CC5CCCCC5)N)(C=O)C(=O)[C@H](CC6CCCCC6)N)C(=O)[C@@H]7CC=CN7C(=O)[C@H](C(C)C)NC(=O)[C@H](CC8CCCCC8)N)N |
Product Overview
Perhydroantamanide (CAS 33906-64-8), with molecular formula C64H102N10O10 and molecular weight 1170.78 g/mol. IUPAC: (2S)-2-amino-N-[(2S)-1-[(2S)-2-[(2S)-2,3-bis[(2S)-2-amino-3-cyclohexylpropanoyl]-3-[(2S)-1-[(2S)-1-[(2S)-2-amino-3-cyclohexylpropanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]-4-[(2S)-2-aminopropanoyl]-2-formylpyrrolidine-1-carbonyl]-2,3-dihydropyrrol-1-yl]-3-methyl-1-oxobutan-2-yl]-3-cyclohexylpropanamide.
Chemical Property Profile of Perhydroantamanide
Property Insights of Perhydroantamanide
The XLogP value of 4.4207 indicates that Perhydroantamanide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 325.79 Ų indicates high polarity, suggesting Perhydroantamanide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Perhydroantamanide has 6 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Perhydroantamanide?
The CAS number of Perhydroantamanide is 33906-64-8.
What is the molecular formula of Perhydroantamanide?
The molecular formula of Perhydroantamanide is C64H102N10O10.
What is the molecular weight of Perhydroantamanide?
The molecular weight of Perhydroantamanide is 1170.78 g/mol.
Where can I buy Perhydroantamanide?
You can request a quote for Perhydroantamanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perhydroantamanide?
Yes, KEHONG BIO provides custom synthesis services for Perhydroantamanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.