D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)
TL;DR: D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) (CAS 122276-80-6) is a chemical compound with molecular formula C20H22Cl2N6O4S2 and molecular weight 544.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-3-[(Z)-[(1E,3R,4S,5R)-1-[(3-chlorophenyl)carbamothioylhydrazinylidene]-3,4,5,6-tetrahydroxyhexan-2-ylidene]amino]thiourea
Also Known As: Glucosone bis-4-(3-chlorophenyl)thiosemicarbazone, D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone), RefChem:1082858
| Molecular Formula | C20H22Cl2N6O4S2 |
|---|---|
| Molecular Weight | 544.05 g/mol |
| LogP | 1.6832 |
| Topological Polar Surface Area | 153.76 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 544.0521 |
| Heavy Atoms | 34 |
| Complexity | 1059.2288 |
Chemical Identifiers
| CAS Number | 122276-80-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=S)N/N=C/C(=N/NC(=S)NC2=CC(=CC=C2)Cl)/[C@H]([C@@H]([C@@H](CO)O)O)O |
Product Overview
D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) (CAS 122276-80-6), with molecular formula C20H22Cl2N6O4S2 and molecular weight 544.05 g/mol. IUPAC: 1-(3-chlorophenyl)-3-[(Z)-[(1E,3R,4S,5R)-1-[(3-chlorophenyl)carbamothioylhydrazinylidene]-3,4,5,6-tetrahydroxyhexan-2-ylidene]amino]thiourea.
Chemical Property Profile of D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)
Property Insights of D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)
The XLogP value of 1.6832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone). The TPSA of 153.76 Ų indicates high polarity, suggesting D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) has 8 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 D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)?
The CAS number of D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) is 122276-80-6.
What is the molecular formula of D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)?
The molecular formula of D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) is C20H22Cl2N6O4S2.
What is the molecular weight of D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)?
The molecular weight of D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) is 544.05 g/mol.
Where can I buy D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)?
You can request a quote for D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone)?
Yes, KEHONG BIO provides custom synthesis services for D-arabino-Hexos-2-ulose, bis((((3-chlorophenyl)amino)thioxomethyl)hydrazone) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.