ST 899
TL;DR: ST 899 (CAS 143484-41-7) is a chemical compound with molecular formula C22H29BrClNO6 and molecular weight 517.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-4-[(2Z)-2-(6-chloro-3-oxo-2-benzofuran-1-ylidene)ethoxy]-2-(3-methylbutanoyloxy)-4-oxobutyl]-trimethylazanium bromide
Also Known As: St 899, [(2R)-4-[(2Z)-2-(6-chloro-3-oxo-2-benzofuran-1-ylidene)ethoxy]-2-(3-methylbutanoyloxy)-4-oxobutyl]-trimethylazanium;bromide, [(2R)-4-[(2Z)-2-(6-chloro-3-oxo-2-benzofuran-1-ylidene)ethoxy]-2-(3-methylbutanoyloxy)-4-oxobutyl]-trimethylazanium bromide, 1-Butanaminium, 4-(2-(6-chloro-3-oxo-1(3H)-isobenzofuranylidene)ethoxy)-N,N,N-trimethyl-2-(3-methyl-1-oxobutoxy)-4-oxo-, bromide, (R-(Z))-, RefChem:185240
| Molecular Formula | C22H29BrClNO6 |
|---|---|
| Molecular Weight | 517.09 g/mol |
| LogP | 0.4527 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 517.0867 |
| Heavy Atoms | 31 |
| Complexity | 846.8931 |
Chemical Identifiers
| CAS Number | 143484-41-7 |
|---|---|
| SMILES | CC(C)CC(=O)O[C@H](CC(=O)OC/C=C\1/C2=C(C=CC(=C2)Cl)C(=O)O1)C[N+](C)(C)C.[Br-] |
Product Overview
ST 899 (CAS 143484-41-7), with molecular formula C22H29BrClNO6 and molecular weight 517.09 g/mol. IUPAC: [(2R)-4-[(2Z)-2-(6-chloro-3-oxo-2-benzofuran-1-ylidene)ethoxy]-2-(3-methylbutanoyloxy)-4-oxobutyl]-trimethylazanium bromide.
Chemical Property Profile of ST 899
Property Insights of ST 899
The XLogP value of 0.4527 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ST 899. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for ST 899. Following Lipinski's Rule of Five, ST 899 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ST 899?
The CAS number of ST 899 is 143484-41-7.
What is the molecular formula of ST 899?
The molecular formula of ST 899 is C22H29BrClNO6.
What is the molecular weight of ST 899?
The molecular weight of ST 899 is 517.09 g/mol.
Where can I buy ST 899?
You can request a quote for ST 899 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ST 899?
Yes, KEHONG BIO provides custom synthesis services for ST 899 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.