C.I. Direct Orange 49 parent
TL;DR: C.I. Direct Orange 49 parent (CAS 59777-85-4) is a chemical compound with molecular formula C37H32N6O15S4 and molecular weight 928.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-[[4-[(3,7-disulfonaphthalen-1-yl)diazenyl]-2-methoxy-5-methylphenyl]carbamoylamino]-5-methoxy-2-methylphenyl]diazenyl]naphthalene-2,6-disulfonic acid
Also Known As: C.I. Direct Orange 49 parent, 4-[[4-[[4-[(3,7-disulfonaphthalen-1-yl)diazenyl]-2-methoxy-5-methylphenyl]carbamoylamino]-5-methoxy-2-methylphenyl]diazenyl]naphthalene-2,6-disulfonic acid
| Molecular Formula | C37H32N6O15S4 |
|---|---|
| Molecular Weight | 928.08 g/mol |
| LogP | 8.08864 |
| Topological Polar Surface Area | 326.51 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 12 |
| Exact Mass | 928.0809 |
| Heavy Atoms | 62 |
| Complexity | 3155.301 |
Chemical Identifiers
| CAS Number | 59777-85-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=CC(=C2)S(=O)(=O)O)S(=O)(=O)O)OC)NC(=O)NC4=C(C=C(C(=C4)C)N=NC5=C6C=C(C=CC6=CC(=C5)S(=O)(=O)O)S(=O)(=O)O)OC |
Product Overview
C.I. Direct Orange 49 parent (CAS 59777-85-4), with molecular formula C37H32N6O15S4 and molecular weight 928.08 g/mol. IUPAC: 4-[[4-[[4-[(3,7-disulfonaphthalen-1-yl)diazenyl]-2-methoxy-5-methylphenyl]carbamoylamino]-5-methoxy-2-methylphenyl]diazenyl]naphthalene-2,6-disulfonic acid.
Chemical Property Profile of C.I. Direct Orange 49 parent
Property Insights of C.I. Direct Orange 49 parent
The XLogP value of 8.08864 indicates that C.I. Direct Orange 49 parent is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 326.51 Ų indicates high polarity, suggesting C.I. Direct Orange 49 parent may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C.I. Direct Orange 49 parent has 6 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C.I. Direct Orange 49 parent?
The CAS number of C.I. Direct Orange 49 parent is 59777-85-4.
What is the molecular formula of C.I. Direct Orange 49 parent?
The molecular formula of C.I. Direct Orange 49 parent is C37H32N6O15S4.
What is the molecular weight of C.I. Direct Orange 49 parent?
The molecular weight of C.I. Direct Orange 49 parent is 928.08 g/mol.
Where can I buy C.I. Direct Orange 49 parent?
You can request a quote for C.I. Direct Orange 49 parent directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C.I. Direct Orange 49 parent?
Yes, KEHONG BIO provides custom synthesis services for C.I. Direct Orange 49 parent and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.