Fluoresceinyl Gabazine, Bromide
TL;DR: Fluoresceinyl Gabazine, Bromide (CAS 1024389-03-4) is a chemical compound with molecular formula C35H27N5O7S and molecular weight 661.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[1-(3-carboxypropyl)-6-iminopyridazin-3-yl]phenyl]carbamothioylamino]-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid
Also Known As: Fluoresceinyl Gabazine, Bromide, 5-[[4-[1-(4-hydroxy-4-oxobutyl)-6-iminopyridazin-3-yl]phenyl]carbamothioylamino]-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid
| Molecular Formula | C35H27N5O7S |
|---|---|
| Molecular Weight | 661.16 g/mol |
| LogP | 5.98527 |
| Topological Polar Surface Area | 190.77 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 661.16315 |
| Heavy Atoms | 48 |
| Complexity | 2314.746 |
Chemical Identifiers
| CAS Number | 1024389-03-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=NN(C(=N)C=C2)CCCC(=O)O)NC(=S)NC3=CC(=C(C=C3)C4=C5C=CC(=O)C=C5OC6=C4C=CC(=C6)O)C(=O)O |
Product Overview
Fluoresceinyl Gabazine, Bromide (CAS 1024389-03-4), with molecular formula C35H27N5O7S and molecular weight 661.16 g/mol. IUPAC: 5-[[4-[1-(3-carboxypropyl)-6-iminopyridazin-3-yl]phenyl]carbamothioylamino]-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid.
Chemical Property Profile of Fluoresceinyl Gabazine, Bromide
Property Insights of Fluoresceinyl Gabazine, Bromide
The XLogP value of 5.98527 indicates that Fluoresceinyl Gabazine, Bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 190.77 Ų indicates high polarity, suggesting Fluoresceinyl Gabazine, Bromide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Fluoresceinyl Gabazine, Bromide has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Fluoresceinyl Gabazine, Bromide?
The CAS number of Fluoresceinyl Gabazine, Bromide is 1024389-03-4.
What is the molecular formula of Fluoresceinyl Gabazine, Bromide?
The molecular formula of Fluoresceinyl Gabazine, Bromide is C35H27N5O7S.
What is the molecular weight of Fluoresceinyl Gabazine, Bromide?
The molecular weight of Fluoresceinyl Gabazine, Bromide is 661.16 g/mol.
Where can I buy Fluoresceinyl Gabazine, Bromide?
You can request a quote for Fluoresceinyl Gabazine, Bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluoresceinyl Gabazine, Bromide?
Yes, KEHONG BIO provides custom synthesis services for Fluoresceinyl Gabazine, Bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.