SR 43845
TL;DR: SR 43845 (CAS 13017-47-5) is a chemical compound with molecular formula C44H64N8O8 and molecular weight 832.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-cyclohexyl-3-hydroxy-4-[[3-(1H-imidazol-5-yl)-2-[[3-phenyl-2-(3-pyridin-3-ylpropanoylamino)propanoyl]amino]propanoyl]amino]pentanoyl]amino]-N-(1,3-dihydroxy-2-methylpropan-2-yl)-3-methylpentanamide
Also Known As: DEXPEMEDOLAC, SR 43845, 2-[[5-cyclohexyl-3-hydroxy-4-[[3-(1H-imidazol-5-yl)-2-[[3-phenyl-2-(3-pyridin-3-ylpropanoylamino)propanoyl]amino]propanoyl]amino]pentanoyl]amino]-N-(1,3-dihydroxy-2-methylpropan-2-yl)-3-methylpentanamide, 13-benzyl-2-(butan-2-yl)-7-(cyclohexylmethyl)-n-(1,3-dihydroxy-2-methylpropan-2-yl)-6-hydroxy-10-(1h-imidazol-5-ylmethyl)-4,9,12,15-tetraoxo-17-(pyridin-3-yl)-3,8,11,14-tetraazaheptadecan-1-amide(non-preferred name), [S-(R*,R*)]-5-Cyclohexyl-2,4,5-trideoxy-N-[1-[[[2-hydroxy-1-(hydroxymethyl)-1-methylethyl]amino]carbonyl]-2-methylbutyl]-4-[[N-[N-[1-oxo-3-(3-pyridinyl)propyl]-L-phenylalanyl]-L-histidyl]amino-L-threo
| Molecular Formula | C44H64N8O8 |
|---|---|
| Molecular Weight | 832.48 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 248.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 24 |
| Exact Mass | 832.48474 |
| Heavy Atoms | 60 |
| Complexity | 1340.0 |
Chemical Identifiers
| CAS Number | 13017-47-5 |
|---|---|
| SMILES | CCC(C)C(C(=O)NC(C)(CO)CO)NC(=O)CC(C(CC1CCCCC1)NC(=O)C(CC2=CN=CN2)NC(=O)C(CC3=CC=CC=C3)NC(=O)CCC4=CN=CC=C4)O |
| InChIKey | NZGWKVVFXREROW-UHFFFAOYSA-N |
Product Overview
SR 43845 (CAS 13017-47-5), with molecular formula C44H64N8O8 and molecular weight 832.48 g/mol. IUPAC: 2-[[5-cyclohexyl-3-hydroxy-4-[[3-(1H-imidazol-5-yl)-2-[[3-phenyl-2-(3-pyridin-3-ylpropanoylamino)propanoyl]amino]propanoyl]amino]pentanoyl]amino]-N-(1,3-dihydroxy-2-methylpropan-2-yl)-3-methylpentanamide.
Chemical Property Profile of SR 43845
Property Insights of SR 43845
The XLogP value of 3.0 indicates that SR 43845 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 248.0 Ų indicates high polarity, suggesting SR 43845 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SR 43845 has 9 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SR 43845?
The CAS number of SR 43845 is 13017-47-5.
What is the molecular formula of SR 43845?
The molecular formula of SR 43845 is C44H64N8O8.
What is the molecular weight of SR 43845?
The molecular weight of SR 43845 is 832.48 g/mol.
Where can I buy SR 43845?
You can request a quote for SR 43845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SR 43845?
Yes, KEHONG BIO provides custom synthesis services for SR 43845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.