AB00117805-01
TL;DR: AB00117805-01 (CAS 432013-84-8) is a chemical compound with molecular formula C16H11ClN2O2S2 and molecular weight 362.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(5-chloro-2-hydroxyphenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: AB00117805-01, (5Z)-5-(5-chloro-2-hydroxybenzylidene)-3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one, (5Z)-5-[(5-chloro-2-hydroxyphenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one, 5-(5-chloro-2-hydroxybenzylidene)-3-(3-pyridinylmethyl)-2-thioxo-1,3-thiazolidin-4-one
| Molecular Formula | C16H11ClN2O2S2 |
|---|---|
| Molecular Weight | 362.00 g/mol |
| LogP | 3.842 |
| Topological Polar Surface Area | 53.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 361.99506 |
| Heavy Atoms | 23 |
| Complexity | 808.9825 |
Chemical Identifiers
| CAS Number | 432013-84-8 |
|---|---|
| SMILES | C1=CC(=CN=C1)CN2C(=O)/C(=C/C3=C(C=CC(=C3)Cl)O)/SC2=S |
Product Overview
AB00117805-01 (CAS 432013-84-8), with molecular formula C16H11ClN2O2S2 and molecular weight 362.00 g/mol. IUPAC: (5Z)-5-[(5-chloro-2-hydroxyphenyl)methylidene]-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of AB00117805-01
Property Insights of AB00117805-01
The XLogP value of 3.842 indicates that AB00117805-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.43 Ų, AB00117805-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00117805-01 has 1 hydrogen bond donor(s) and 5 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 AB00117805-01?
The CAS number of AB00117805-01 is 432013-84-8.
What is the molecular formula of AB00117805-01?
The molecular formula of AB00117805-01 is C16H11ClN2O2S2.
What is the molecular weight of AB00117805-01?
The molecular weight of AB00117805-01 is 362.00 g/mol.
Where can I buy AB00117805-01?
You can request a quote for AB00117805-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00117805-01?
Yes, KEHONG BIO provides custom synthesis services for AB00117805-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.