RefChem:465285
TL;DR: RefChem:465285 (CAS 58965-11-0) is a chemical compound with molecular formula C24H22N2O5S and molecular weight 450.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-(4-butylanilino)-9,10-dioxoanthracene-2-sulfonic acid
Also Known As: 2-Anthracenesulfonic acid, 1-amino-4-[(4-butylphenyl)amino]-9,10-dihydro-9,10-dioxo-, 1-amino-4-(4-butylanilino)-9,10-dioxoanthracene-2-sulfonic acid, 1-amino-4-[(4-butylphenyl)amino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonic acid, 2-Anthracenesulfonic acid, 1-amino-4-((4-butylphenyl)amino)-9,10-dihydro-9,10-dioxo-, 1-Amino-4-((4-butylphenyl)amino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonic acid
| Molecular Formula | C24H22N2O5S |
|---|---|
| Molecular Weight | 450.12 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.12494 |
| Heavy Atoms | 32 |
| Complexity | 802.0 |
Chemical Identifiers
| CAS Number | 58965-11-0 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)S(=O)(=O)O |
| InChIKey | RVKLSGHATZZOCO-UHFFFAOYSA-N |
Product Overview
RefChem:465285 (CAS 58965-11-0), with molecular formula C24H22N2O5S and molecular weight 450.12 g/mol. IUPAC: 1-amino-4-(4-butylanilino)-9,10-dioxoanthracene-2-sulfonic acid.
Chemical Property Profile of RefChem:465285
Property Insights of RefChem:465285
The XLogP value of 5.5 indicates that RefChem:465285 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:465285. Following Lipinski's Rule of Five, RefChem:465285 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:465285?
The CAS number of RefChem:465285 is 58965-11-0.
What is the molecular formula of RefChem:465285?
The molecular formula of RefChem:465285 is C24H22N2O5S.
What is the molecular weight of RefChem:465285?
The molecular weight of RefChem:465285 is 450.12 g/mol.
Where can I buy RefChem:465285?
You can request a quote for RefChem:465285 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:465285?
Yes, KEHONG BIO provides custom synthesis services for RefChem:465285 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.