Cgp 38560
TL;DR: Cgp 38560 (CAS 122088-76-0) is a chemical compound with molecular formula C39H64N6O9S2 and molecular weight 824.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-2-amino-3-cyclohexylpropanoyl]-N-[(2S)-2-[[(2R)-2-benzyl-3-tert-butylsulfonylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]-2-(butylamino)-3-methylbutanamide;methanesulfonic acid
Also Known As: Cgp 38560, Cgp 38560A, L-Valinamide, N-(2-(((1,1-dimethylethyl)sulfonyl)methyl)-1-oxo-3-phenylpropyl)-L-histidyl-3-cyclohexyl-L-alanyl-N-butyl-, (R)-, monomethanesulfonate, N-(2-Benzyl-3-tert-butylsulfonylpropionyl)-his-cha-val-n-butylamide, (2S)-N-[(2S)-2-amino-3-cyclohexylpropanoyl]-N-[(2S)-2-[[(2R)-2-benzyl-3-tert-butylsulfonylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]-2-(butylamino)-3-methylbutanamide;methanesulfonic acid
| Molecular Formula | C39H64N6O9S2 |
|---|---|
| Molecular Weight | 824.42 g/mol |
| LogP | 3.607 |
| Topological Polar Surface Area | 238.79 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 18 |
| Exact Mass | 824.4176 |
| Heavy Atoms | 56 |
| Complexity | 1748.8535 |
Chemical Identifiers
| CAS Number | 122088-76-0 |
|---|---|
| SMILES | CCCCN[C@@H](C(C)C)C(=O)N(C(=O)[C@H](CC1CCCCC1)N)C(=O)[C@H](CC2=CN=CN2)NC(=O)[C@@H](CC3=CC=CC=C3)CS(=O)(=O)C(C)(C)C.CS(=O)(=O)O |
Product Overview
Cgp 38560 (CAS 122088-76-0), with molecular formula C39H64N6O9S2 and molecular weight 824.42 g/mol. IUPAC: (2S)-N-[(2S)-2-amino-3-cyclohexylpropanoyl]-N-[(2S)-2-[[(2R)-2-benzyl-3-tert-butylsulfonylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoyl]-2-(butylamino)-3-methylbutanamide;methanesulfonic acid.
Chemical Property Profile of Cgp 38560
Property Insights of Cgp 38560
The XLogP value of 3.607 indicates that Cgp 38560 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 238.79 Ų indicates high polarity, suggesting Cgp 38560 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cgp 38560 has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cgp 38560?
The CAS number of Cgp 38560 is 122088-76-0.
What is the molecular formula of Cgp 38560?
The molecular formula of Cgp 38560 is C39H64N6O9S2.
What is the molecular weight of Cgp 38560?
The molecular weight of Cgp 38560 is 824.42 g/mol.
Where can I buy Cgp 38560?
You can request a quote for Cgp 38560 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cgp 38560?
Yes, KEHONG BIO provides custom synthesis services for Cgp 38560 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.