EINECS 241-805-9
TL;DR: EINECS 241-805-9 (CAS 17852-69-6) is a chemical compound with molecular formula C24H26N2O5SSe and molecular weight 534.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[(1-ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-5-methoxy-1,3-benzoselenazol-3-yl]propane-1-sulfonate
Also Known As: 3-[2-[(1-ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-5-methoxy-1,3-benzoselenazol-3-yl]propane-1-sulfonate, 1-Ethyl-6-methoxy-2-((5-methoxy-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene)methyl)quinolinium, 1-ethyl-6-methoxy-2-[[5-methoxy-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene]methyl]quinoliniu, 1-ETHYL-6-METHOXY-2-[[5-METHOXY-3-(3-SULFONATOPROPYL)-3H-BENZOSELENAZOL-2-YLIDENE]METHYL]QUINOLINIUM, 1-ethyl-6-methoxy-2-[[5-methoxy-3-(3-sulphonatopropyl)-3H-benzoselenazol-2-ylidene]methyl]quinolinium
| Molecular Formula | C24H26N2O5SSe |
|---|---|
| Molecular Weight | 534.07 g/mol |
| LogP | 2.25 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 534.07275 |
| Heavy Atoms | 33 |
| Complexity | 775.0 |
Chemical Identifiers
| CAS Number | 17852-69-6 |
|---|---|
| SMILES | CC[N+]1=C(C=CC2=C1C=CC(=C2)OC)C=C3N(C4=C([Se]3)C=CC(=C4)OC)CCCS(=O)(=O)[O-] |
| InChIKey | TULGBBGFVMDUFF-UHFFFAOYSA-N |
Product Overview
EINECS 241-805-9 (CAS 17852-69-6), with molecular formula C24H26N2O5SSe and molecular weight 534.07 g/mol. IUPAC: 3-[2-[(1-ethyl-6-methoxyquinolin-1-ium-2-yl)methylidene]-5-methoxy-1,3-benzoselenazol-3-yl]propane-1-sulfonate.
Chemical Property Profile of EINECS 241-805-9
Property Insights of EINECS 241-805-9
The XLogP value of 2.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 241-805-9. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 241-805-9. Following Lipinski's Rule of Five, EINECS 241-805-9 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 EINECS 241-805-9?
The CAS number of EINECS 241-805-9 is 17852-69-6.
What is the molecular formula of EINECS 241-805-9?
The molecular formula of EINECS 241-805-9 is C24H26N2O5SSe.
What is the molecular weight of EINECS 241-805-9?
The molecular weight of EINECS 241-805-9 is 534.07 g/mol.
Where can I buy EINECS 241-805-9?
You can request a quote for EINECS 241-805-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 241-805-9?
Yes, KEHONG BIO provides custom synthesis services for EINECS 241-805-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.