KST-1B7976
TL;DR: KST-1B7976 (CAS 7150-38-1) is a chemical compound with molecular formula C22H12O6S and molecular weight 404.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-carboxyphenyl)sulfanyl-9,10-dioxoanthracene-2-carboxylic acid
Also Known As: KST-1B7976, 1-[(2-carboxyphenyl)sulfanyl]-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid, 1-(2-carboxyphenyl)sulfanyl-9,10-dioxoanthracene-2-carboxylic acid, 1-(2-carboxyphenyl)sulfanyl-9,10-dioxoanthracene-2-carboxyli, 2-Anthracenecarboxylicacid, 1-[(2-carboxyphenyl)thio]-9,10-dihydro-9,10-dioxo-
| Molecular Formula | C22H12O6S |
|---|---|
| Molecular Weight | 404.04 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.03546 |
| Heavy Atoms | 29 |
| Complexity | 705.0 |
Chemical Identifiers
| CAS Number | 7150-38-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)O)SC4=CC=CC=C4C(=O)O |
| InChIKey | OHGQGGISUGFMBA-UHFFFAOYSA-N |
Product Overview
KST-1B7976 (CAS 7150-38-1), with molecular formula C22H12O6S and molecular weight 404.04 g/mol. IUPAC: 1-(2-carboxyphenyl)sulfanyl-9,10-dioxoanthracene-2-carboxylic acid.
Chemical Property Profile of KST-1B7976
Property Insights of KST-1B7976
The XLogP value of 4.0 indicates that KST-1B7976 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1B7976. Following Lipinski's Rule of Five, KST-1B7976 has 2 hydrogen bond donor(s) and 7 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 KST-1B7976?
The CAS number of KST-1B7976 is 7150-38-1.
What is the molecular formula of KST-1B7976?
The molecular formula of KST-1B7976 is C22H12O6S.
What is the molecular weight of KST-1B7976?
The molecular weight of KST-1B7976 is 404.04 g/mol.
Where can I buy KST-1B7976?
You can request a quote for KST-1B7976 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B7976?
Yes, KEHONG BIO provides custom synthesis services for KST-1B7976 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.