RefChem:444155
TL;DR: RefChem:444155 (CAS 6273-47-8) is a chemical compound with molecular formula C12H5Cl3NNaO2 and molecular weight 322.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 2-chloro-4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate
Also Known As: 2,3',6-Trichloroindophenol sodium salt, 2,3',6-TRICHLOROINDOPHENOLSODIUMSALT, 2,5-Cyclohexadien-1-one, 2,6-dichloro-4-((3-chloro-4-hydroxyphenyl)imino)-, monosodium salt, 4-((3-Chloro-4-hydroxyphenyl)imino)-2,6-dichloro-2,5-cyclohexadien-1-one sodium salt, 2,5-Cyclohexadien-1-one, 2,6-dichloro-4-[(3-chloro-4-hydroxyphenyl)imino]-, monosodium salt
| Molecular Formula | C12H5Cl3NNaO2 |
|---|---|
| Molecular Weight | 322.93 g/mol |
| LogP | 0.3182 |
| Topological Polar Surface Area | 52.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 322.92834 |
| Heavy Atoms | 19 |
| Complexity | 599.4006 |
Chemical Identifiers
| CAS Number | 6273-47-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1N=C2C=C(C(=O)C(=C2)Cl)Cl)Cl)[O-].[Na+] |
Product Overview
RefChem:444155 (CAS 6273-47-8), with molecular formula C12H5Cl3NNaO2 and molecular weight 322.93 g/mol. IUPAC: sodium 2-chloro-4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate.
Chemical Property Profile of RefChem:444155
Property Insights of RefChem:444155
The XLogP value of 0.3182 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:444155. With a topological polar surface area (TPSA) of 52.49 Ų, RefChem:444155 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:444155 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:444155?
The CAS number of RefChem:444155 is 6273-47-8.
What is the molecular formula of RefChem:444155?
The molecular formula of RefChem:444155 is C12H5Cl3NNaO2.
What is the molecular weight of RefChem:444155?
The molecular weight of RefChem:444155 is 322.93 g/mol.
Where can I buy RefChem:444155?
You can request a quote for RefChem:444155 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:444155?
Yes, KEHONG BIO provides custom synthesis services for RefChem:444155 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.