EINECS 299-500-1
TL;DR: EINECS 299-500-1 (CAS 93892-19-4) is a chemical compound with molecular formula C22H17N3O9S2 and molecular weight 531.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-acetamidoanilino)-8-amino-9,10-dioxoanthracene-1,7-disulfonic acid
Also Known As: EINECS 299-500-1, 5-((4-(Acetylamino)phenyl)amino)-8-amino-9,10-dihydro-9,10-dioxoanthracene-1,7-disulphonic acid, 5-(4-acetamidoanilino)-8-amino-9,10-dioxoanthracene-1,7-disulfonic acid, 5-((4-Acetamidophenyl)amino)-8-amino-9,10-dioxo-9,10-dihydroanthracene-1,7-disulfonicacid, 5-(4-Acetamidoanilino)-8-amino-9,10-dioxo-9,10-dihydroanthracene-1,7-disulfonic acid
| Molecular Formula | C22H17N3O9S2 |
|---|---|
| Molecular Weight | 531.04 g/mol |
| LogP | 2.2396 |
| Topological Polar Surface Area | 210.03 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 531.04065 |
| Heavy Atoms | 36 |
| Complexity | 1695.4386 |
Chemical Identifiers
| CAS Number | 93892-19-4 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=C(C3=O)C(=CC=C4)S(=O)(=O)O)N)S(=O)(=O)O |
Product Overview
EINECS 299-500-1 (CAS 93892-19-4), with molecular formula C22H17N3O9S2 and molecular weight 531.04 g/mol. IUPAC: 5-(4-acetamidoanilino)-8-amino-9,10-dioxoanthracene-1,7-disulfonic acid.
Chemical Property Profile of EINECS 299-500-1
Property Insights of EINECS 299-500-1
The XLogP value of 2.2396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 299-500-1. The TPSA of 210.03 Ų indicates high polarity, suggesting EINECS 299-500-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 299-500-1 has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 299-500-1?
The CAS number of EINECS 299-500-1 is 93892-19-4.
What is the molecular formula of EINECS 299-500-1?
The molecular formula of EINECS 299-500-1 is C22H17N3O9S2.
What is the molecular weight of EINECS 299-500-1?
The molecular weight of EINECS 299-500-1 is 531.04 g/mol.
Where can I buy EINECS 299-500-1?
You can request a quote for EINECS 299-500-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 299-500-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 299-500-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.