EINECS 275-375-9
TL;DR: EINECS 275-375-9 (CAS 71411-71-7) is a chemical compound with molecular formula C21H16N2O7S2 and molecular weight 472.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-9,10-dioxoanthracen-1-yl)sulfamoyl]-5-methylbenzenesulfonic acid
Also Known As: EINECS 275-375-9, 4-(((4-Amino-9,10-dihydro-9,10-dioxo-1-anthryl)amino)sulphonyl)toluene-3-sulphonic acid, 2-[(4-AMINO-9,10-DIOXO-9,10-DIHYDROANTHRACEN-1-YL)SULFAMOYL]-5-METHYLBENZENE-1-SULFONIC ACID, 2-[(4-amino-9,10-dioxoanthracen-1-yl)sulfamoyl]-5-methylbenzenesulfonic acid, 4-[[(4-amino-9,10-dihydro-9,10-dioxo-1-anthryl)amino]sulphonyl]toluene-3-sulphonic acid
| Molecular Formula | C21H16N2O7S2 |
|---|---|
| Molecular Weight | 472.04 g/mol |
| LogP | 2.40012 |
| Topological Polar Surface Area | 160.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.0399 |
| Heavy Atoms | 32 |
| Complexity | 1542.3081 |
Chemical Identifiers
| CAS Number | 71411-71-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)S(=O)(=O)NC2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O)S(=O)(=O)O |
Product Overview
EINECS 275-375-9 (CAS 71411-71-7), with molecular formula C21H16N2O7S2 and molecular weight 472.04 g/mol. IUPAC: 2-[(4-amino-9,10-dioxoanthracen-1-yl)sulfamoyl]-5-methylbenzenesulfonic acid.
Chemical Property Profile of EINECS 275-375-9
Property Insights of EINECS 275-375-9
The XLogP value of 2.40012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 275-375-9. The TPSA of 160.7 Ų indicates high polarity, suggesting EINECS 275-375-9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 275-375-9 has 3 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 EINECS 275-375-9?
The CAS number of EINECS 275-375-9 is 71411-71-7.
What is the molecular formula of EINECS 275-375-9?
The molecular formula of EINECS 275-375-9 is C21H16N2O7S2.
What is the molecular weight of EINECS 275-375-9?
The molecular weight of EINECS 275-375-9 is 472.04 g/mol.
Where can I buy EINECS 275-375-9?
You can request a quote for EINECS 275-375-9 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 275-375-9?
Yes, KEHONG BIO provides custom synthesis services for EINECS 275-375-9 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.