RefChem:564226
TL;DR: RefChem:564226 (CAS 65122-39-6) is a chemical compound with molecular formula C38H42N2O8S2 and molecular weight 718.2383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[9,10-dioxo-4-(2,4,6-triethyl-3-sulfoanilino)anthracen-1-yl]amino]-2,4,6-triethylbenzenesulfonic acid
Also Known As: D-Ribose, diphenyl mercaptal, Ribose, diphenyl mercaptal, D-, Metanilic acid, N,N'-1,4-anthraquinonylenebis(2,4,6-triethyl-, Benzenesulfonic acid, 3,3'-[(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)diimino]bis[2,4,6-triethyl-, 3,3'-[(9,10-dioxo-9,10-dihydroanthracene-1,4-diyl)diimino]bis(2,4,6-triethylbenzenesulfonic acid)
Technical Specifications
| Molecular Formula | C38H42N2O8S2 |
| Molecular Weight | 718.2383 g/mol |
| XLogP | 8.2 |
| Topological Polar Surface Area (TPSA) | 184.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 718.2383 Da |
| Heavy Atoms | 50 |
| Complexity | 1300.0 |
| SMILES | CCC1=CC(=C(C(=C1NC2=C3C(=C(C=C2)NC4=C(C(=C(C=C4CC)CC)S(=O)(=O)O)CC)C(=O)C5=CC=CC=C5C3=O)CC)S(=O)(=O)O)CC |
| InChIKey | JPIJFOIMQDDHFY-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:564226
Property Insights of RefChem:564226
The XLogP value of 8.2 indicates that RefChem:564226 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.0 Ų indicates high polarity, suggesting RefChem:564226 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:564226 has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:564226?
The CAS number of RefChem:564226 is 65122-39-6.
What is the molecular formula of RefChem:564226?
The molecular formula of RefChem:564226 is C38H42N2O8S2.
What is the molecular weight of RefChem:564226?
The molecular weight of RefChem:564226 is 718.2383 g/mol.
Where can I buy RefChem:564226?
You can request a quote for RefChem:564226 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:564226?
Yes, CoreyChem provides custom synthesis services for RefChem:564226 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.