EINECS 278-187-5
TL;DR: EINECS 278-187-5 (CAS 75313-88-1) is a chemical compound with molecular formula C21H16N2O6S and molecular weight 424.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-(2-methoxyanilino)-9,10-dioxoanthracene-2-sulfonic acid
Also Known As: EINECS 278-187-5, 1-Amino-9,10-dihydro-4-((2-methoxyphenyl)amino)-9,10-dioxoanthracene-2-sulphonic acid, 1-amino-4-(2-methoxyanilino)-9,10-dioxoanthracene-2-sulfonic acid, 1-amino-4-[(2-methoxyphenyl)amino]-9,10-dioxoanthracene-2-sulfonic acid, 1-amino-9,10-dihydro-4-[ amino]-9,10-dioxoanthracene-2-sulphonicacid
| Molecular Formula | C21H16N2O6S |
|---|---|
| Molecular Weight | 424.07 g/mol |
| LogP | 3.0431 |
| Topological Polar Surface Area | 135.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.0729 |
| Heavy Atoms | 30 |
| Complexity | 1331.3184 |
Chemical Identifiers
| CAS Number | 75313-88-1 |
|---|---|
| SMILES | COC1=CC=CC=C1NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O |
Product Overview
EINECS 278-187-5 (CAS 75313-88-1), with molecular formula C21H16N2O6S and molecular weight 424.07 g/mol. IUPAC: 1-amino-4-(2-methoxyanilino)-9,10-dioxoanthracene-2-sulfonic acid.
Chemical Property Profile of EINECS 278-187-5
Property Insights of EINECS 278-187-5
The XLogP value of 3.0431 indicates that EINECS 278-187-5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.79 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 278-187-5. Following Lipinski's Rule of Five, EINECS 278-187-5 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 278-187-5?
The CAS number of EINECS 278-187-5 is 75313-88-1.
What is the molecular formula of EINECS 278-187-5?
The molecular formula of EINECS 278-187-5 is C21H16N2O6S.
What is the molecular weight of EINECS 278-187-5?
The molecular weight of EINECS 278-187-5 is 424.07 g/mol.
Where can I buy EINECS 278-187-5?
You can request a quote for EINECS 278-187-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 278-187-5?
Yes, KEHONG BIO provides custom synthesis services for EINECS 278-187-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.