BAS 00779392
TL;DR: BAS 00779392 (CAS 181475-76-3) is a chemical compound with molecular formula C21H19FN2O3S2 and molecular weight 430.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-3-[(5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide
Also Known As: BAS 00779392, AF-399/32023025, N-(4-ethoxyphenyl)-3-[(5Z)-5-(4-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanamide, (Z)-N-(4-ethoxyphenyl)-3-(5-(4-fluorobenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanamide, N-(4-ethoxyphenyl)-3-[(5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide
| Molecular Formula | C21H19FN2O3S2 |
|---|---|
| Molecular Weight | 430.08 g/mol |
| LogP | 4.4544 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 430.08212 |
| Heavy Atoms | 29 |
| Complexity | 943.4035 |
Chemical Identifiers
| CAS Number | 181475-76-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CCN2C(=O)/C(=C/C3=CC=C(C=C3)F)/SC2=S |
Product Overview
BAS 00779392 (CAS 181475-76-3), with molecular formula C21H19FN2O3S2 and molecular weight 430.08 g/mol. IUPAC: N-(4-ethoxyphenyl)-3-[(5Z)-5-[(4-fluorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide.
Chemical Property Profile of BAS 00779392
Property Insights of BAS 00779392
The XLogP value of 4.4544 indicates that BAS 00779392 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BAS 00779392 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00779392 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 BAS 00779392?
The CAS number of BAS 00779392 is 181475-76-3.
What is the molecular formula of BAS 00779392?
The molecular formula of BAS 00779392 is C21H19FN2O3S2.
What is the molecular weight of BAS 00779392?
The molecular weight of BAS 00779392 is 430.08 g/mol.
Where can I buy BAS 00779392?
You can request a quote for BAS 00779392 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00779392?
Yes, KEHONG BIO provides custom synthesis services for BAS 00779392 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.