AB00094382-01
TL;DR: AB00094382-01 (CAS 5711-99-9) is a chemical compound with molecular formula C20H16N2O2S2 and molecular weight 380.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-3-(4-methoxyphenyl)-5-[(1-methylindol-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AB00094382-01, (5E)-3-(4-methoxyphenyl)-5-[(1-methylindol-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-3-(4-Methoxyphenyl)-5-[(1-methyl-1H-indol-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
| Molecular Formula | C20H16N2O2S2 |
|---|---|
| Molecular Weight | 380.07 g/mol |
| LogP | 4.5927 |
| Topological Polar Surface Area | 34.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.0653 |
| Heavy Atoms | 26 |
| Complexity | 1051.3634 |
Chemical Identifiers
| CAS Number | 5711-99-9 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)/C=C/3\C(=O)N(C(=S)S3)C4=CC=C(C=C4)OC |
Product Overview
AB00094382-01 (CAS 5711-99-9), with molecular formula C20H16N2O2S2 and molecular weight 380.07 g/mol. IUPAC: (5E)-3-(4-methoxyphenyl)-5-[(1-methylindol-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of AB00094382-01
Property Insights of AB00094382-01
The XLogP value of 4.5927 indicates that AB00094382-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.47 Ų, AB00094382-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00094382-01 has 0 hydrogen bond donor(s) and 4 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 AB00094382-01?
The CAS number of AB00094382-01 is 5711-99-9.
What is the molecular formula of AB00094382-01?
The molecular formula of AB00094382-01 is C20H16N2O2S2.
What is the molecular weight of AB00094382-01?
The molecular weight of AB00094382-01 is 380.07 g/mol.
Where can I buy AB00094382-01?
You can request a quote for AB00094382-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00094382-01?
Yes, KEHONG BIO provides custom synthesis services for AB00094382-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.