多库酯
TL;DR: 多库酯 (CAS 577-11-7) is a chemical compound with molecular formula C20H37NaO7S and molecular weight 444.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
多库酯
sodium 1,4-dioctoxy-1,4-dioxobutane-2-sulfonate
Also Known As: Butyl-cerumen, Bu-cerumen, Solbaleite, Texapon DOS, Noname
| Molecular Formula | C20H37NaO7S |
|---|---|
| Molecular Weight | 444.22 g/mol |
| LogP | 1.1017 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 20 |
| Exact Mass | 444.21576 |
| Heavy Atoms | 29 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 577-11-7 |
|---|---|
| SMILES | CCCCCCCCOC(=O)CC(C(=O)OCCCCCCCC)S(=O)(=O)[O-].[Na+] |
| InChIKey | RCIJACVHOIKRAP-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
多库酯 (CAS 577-11-7), with molecular formula C20H37NaO7S and molecular weight 444.22 g/mol. IUPAC: sodium 1,4-dioctoxy-1,4-dioxobutane-2-sulfonate.
Chemical Property Profile of 多库酯
Property Insights of 多库酯
The XLogP value of 1.1017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 多库酯. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 多库酯. Following Lipinski's Rule of Five, 多库酯 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 多库酯?
The CAS number of 多库酯 is 577-11-7.
What is the molecular formula of 多库酯?
The molecular formula of 多库酯 is C20H37NaO7S.
What is the molecular weight of 多库酯?
The molecular weight of 多库酯 is 444.22 g/mol.
Where can I buy 多库酯?
You can request a quote for 多库酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 多库酯?
Yes, KEHONG BIO provides custom synthesis services for 多库酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.