Vat Solubilized Gray S
TL;DR: Vat Solubilized Gray S (CAS 34599-04-7) is a chemical compound with molecular formula C45H19N3Na4O16S4 and molecular weight 1076.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetrasodium;(4,13,29-trisulfonatooxy-6,25,48-triazatridecacyclo[25.18.2.139,42.02,22.05,21.07,20.08,17.010,15.024,46.028,41.031,40.033,38.043,47]octatetraconta-1,3,5(21),6,8,10,12,15,17,19,22,24(46),25,27,29,31,33,35,37,39(48),40,43(47),44-tricosaen-44-yl) sulfate
Also Known As: Vat Solubilized Gray S, Kubosol Gray S, Anthrasol Grey IMG, C.I. Solubilized Vat Black 8, tetrasodium 4,18a-dihydrobenzo[lmn]naphtho[2',3':7,8]carbazolo[3,4-b]naphtho[1',2',3':3,4]isoindolo[7,1-ij]phenanthridine-3,11,19,22-tetrayl tetrasulfate
| Molecular Formula | C45H19N3Na4O16S4 |
|---|---|
| Molecular Weight | 1076.92 g/mol |
| LogP | -7.79532 |
| Topological Polar Surface Area | 336.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 4 |
| Exact Mass | 1076.924 |
| Heavy Atoms | 72 |
| Complexity | 3270.0 |
Chemical Identifiers
| CAS Number | 34599-04-7 |
|---|---|
| SMILES | C1C(=CC=C2C1=CC3=CC=C4C5=C(C(=CC6=C7C=C(C8=C9C7=C(C=C65)N=CC9=C1C(=CC5=CC6=CC=CC=C6C6=NC8C1=C56)OS(=O)(=O)[O-])OS(=O)(=O)[O-])OS(=O)(=O)[O-])N=C4C3=C2)OS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+] |
| InChIKey | YHVWFMCFWYDREW-UHFFFAOYSA-J |
Product Overview
Vat Solubilized Gray S (CAS 34599-04-7), with molecular formula C45H19N3Na4O16S4 and molecular weight 1076.92 g/mol. IUPAC: tetrasodium;(4,13,29-trisulfonatooxy-6,25,48-triazatridecacyclo[25.18.2.139,42.02,22.05,21.07,20.08,17.010,15.024,46.028,41.031,40.033,38.043,47]octatetraconta-1,3,5(21),6,8,10,12,15,17,19,22,24(46),25,27,29,31,33,35,37,39(48),40,43(47),44-tricosaen-44-yl) sulfate.
Chemical Property Profile of Vat Solubilized Gray S
Property Insights of Vat Solubilized Gray S
The XLogP value of -7.79532 indicates that Vat Solubilized Gray S is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 336.0 Ų indicates high polarity, suggesting Vat Solubilized Gray S may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Vat Solubilized Gray S has 0 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Vat Solubilized Gray S?
The CAS number of Vat Solubilized Gray S is 34599-04-7.
What is the molecular formula of Vat Solubilized Gray S?
The molecular formula of Vat Solubilized Gray S is C45H19N3Na4O16S4.
What is the molecular weight of Vat Solubilized Gray S?
The molecular weight of Vat Solubilized Gray S is 1076.92 g/mol.
Where can I buy Vat Solubilized Gray S?
You can request a quote for Vat Solubilized Gray S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vat Solubilized Gray S?
Yes, KEHONG BIO provides custom synthesis services for Vat Solubilized Gray S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.