去中心化識別
TL;DR: 去中心化識別 (CAS 53005-05-3) is a chemical compound with molecular formula C16H10N2O6S4 and molecular weight 453.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
去中心化識別
5-isothiocyanato-2-[2-(4-isothiocyanato-2-sulfophenyl)ethenyl]benzenesulfonic acid
Also Known As: dids, ABC inhibitor 2, DIDS disodium salt, DIDS [MI], 4,4'-Diisothiocyanostilbene-2,2'-disulfonic acid
| Molecular Formula | C16H10N2O6S4 |
|---|---|
| Molecular Weight | 453.94 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 453.94217 |
| Heavy Atoms | 28 |
| Complexity | 818.0 |
Chemical Identifiers
| CAS Number | 53005-05-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1N=C=S)S(=O)(=O)O)C=CC2=C(C=C(C=C2)N=C=S)S(=O)(=O)O |
| InChIKey | YSCNMFDFYJUPEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
去中心化識別 (CAS 53005-05-3), with molecular formula C16H10N2O6S4 and molecular weight 453.94 g/mol. IUPAC: 5-isothiocyanato-2-[2-(4-isothiocyanato-2-sulfophenyl)ethenyl]benzenesulfonic acid.
Chemical Property Profile of 去中心化識別
Property Insights of 去中心化識別
The XLogP value of 4.5 indicates that 去中心化識別 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 214.0 Ų indicates high polarity, suggesting 去中心化識別 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 去中心化識別 has 2 hydrogen bond donor(s) and 10 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 去中心化識別?
The CAS number of 去中心化識別 is 53005-05-3.
What is the molecular formula of 去中心化識別?
The molecular formula of 去中心化識別 is C16H10N2O6S4.
What is the molecular weight of 去中心化識別?
The molecular weight of 去中心化識別 is 453.94 g/mol.
Where can I buy 去中心化識別?
You can request a quote for 去中心化識別 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 去中心化識別?
Yes, KEHONG BIO provides custom synthesis services for 去中心化識別 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.