AB00117734-01
TL;DR: AB00117734-01 (CAS 432012-42-5) is a chemical compound with molecular formula C18H15IN2O3S2 and molecular weight 497.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AB00117734-01, (5Z)-5-(3-ethoxy-4-hydroxy-5-iodobenzylidene)-3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-5-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 5-(3-ethoxy-4-hydroxy-5-iodobenzylidene)-3-(3-pyridinylmethyl)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C18H15IN2O3S2 |
|---|---|
| Molecular Weight | 497.96 g/mol |
| LogP | 4.1919 |
| Topological Polar Surface Area | 62.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 497.95688 |
| Heavy Atoms | 26 |
| Complexity | 887.505 |
Chemical Identifiers
| CAS Number | 432012-42-5 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CC3=CN=CC=C3)I)O |
Product Overview
AB00117734-01 (CAS 432012-42-5), with molecular formula C18H15IN2O3S2 and molecular weight 497.96 g/mol. IUPAC: (5Z)-5-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of AB00117734-01
Property Insights of AB00117734-01
The XLogP value of 4.1919 indicates that AB00117734-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.66 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00117734-01. Following Lipinski's Rule of Five, AB00117734-01 has 1 hydrogen bond donor(s) and 6 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 AB00117734-01?
The CAS number of AB00117734-01 is 432012-42-5.
What is the molecular formula of AB00117734-01?
The molecular formula of AB00117734-01 is C18H15IN2O3S2.
What is the molecular weight of AB00117734-01?
The molecular weight of AB00117734-01 is 497.96 g/mol.
Where can I buy AB00117734-01?
You can request a quote for AB00117734-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117734-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117734-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.