BAS 00777859
TL;DR: BAS 00777859 (CAS 265098-85-9) is a chemical compound with molecular formula C18H21NO4S2 and molecular weight 379.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 3-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate
Also Known As: BAS 00777859, butyl 3-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate, F0207-0315, (Z)-butyl 3-(5-(4-methoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)propanoate, butyl 3-{5-[(4-methoxyphenyl)methylene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}pr opanoate
| Molecular Formula | C18H21NO4S2 |
|---|---|
| Molecular Weight | 379.09 g/mol |
| LogP | 3.6298 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 379.0912 |
| Heavy Atoms | 25 |
| Complexity | 670.15857 |
Chemical Identifiers
| CAS Number | 265098-85-9 |
|---|---|
| SMILES | CCCCOC(=O)CCN1C(=O)/C(=C/C2=CC=C(C=C2)OC)/SC1=S |
Product Overview
BAS 00777859 (CAS 265098-85-9), with molecular formula C18H21NO4S2 and molecular weight 379.09 g/mol. IUPAC: butyl 3-[(5Z)-5-[(4-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate.
Chemical Property Profile of BAS 00777859
Property Insights of BAS 00777859
The XLogP value of 3.6298 indicates that BAS 00777859 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, BAS 00777859 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00777859 has 0 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 BAS 00777859?
The CAS number of BAS 00777859 is 265098-85-9.
What is the molecular formula of BAS 00777859?
The molecular formula of BAS 00777859 is C18H21NO4S2.
What is the molecular weight of BAS 00777859?
The molecular weight of BAS 00777859 is 379.09 g/mol.
Where can I buy BAS 00777859?
You can request a quote for BAS 00777859 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00777859?
Yes, KEHONG BIO provides custom synthesis services for BAS 00777859 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.