BAS 00776730
TL;DR: BAS 00776730 (CAS 302934-40-3) is a chemical compound with molecular formula C14H11Cl2NO3S3 and molecular weight 406.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2,4-dichlorophenyl)methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BAS 00776730, BIM-0024205.P001, AB00088928-01, (Z)-5-(2,4-dichlorobenzylidene)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-2-thioxothiazolidin-4-one, F0095-2319
| Molecular Formula | C14H11Cl2NO3S3 |
|---|---|
| Molecular Weight | 406.93 g/mol |
| LogP | 3.3817 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 406.92783 |
| Heavy Atoms | 23 |
| Complexity | 835.6693 |
Chemical Identifiers
| CAS Number | 302934-40-3 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1N2C(=O)/C(=C/C3=C(C=C(C=C3)Cl)Cl)/SC2=S |
Product Overview
BAS 00776730 (CAS 302934-40-3), with molecular formula C14H11Cl2NO3S3 and molecular weight 406.93 g/mol. IUPAC: (5Z)-5-[(2,4-dichlorophenyl)methylidene]-3-(1,1-dioxothiolan-3-yl)-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BAS 00776730
Property Insights of BAS 00776730
The XLogP value of 3.3817 indicates that BAS 00776730 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.45 Ų, BAS 00776730 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00776730 has 0 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 00776730?
The CAS number of BAS 00776730 is 302934-40-3.
What is the molecular formula of BAS 00776730?
The molecular formula of BAS 00776730 is C14H11Cl2NO3S3.
What is the molecular weight of BAS 00776730?
The molecular weight of BAS 00776730 is 406.93 g/mol.
Where can I buy BAS 00776730?
You can request a quote for BAS 00776730 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00776730?
Yes, KEHONG BIO provides custom synthesis services for BAS 00776730 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.