BIM-0031412.P001
TL;DR: BIM-0031412.P001 (CAS 299905-40-1) is a chemical compound with molecular formula C17H11ClFNO2S2 and molecular weight 378.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
Also Known As: BIM-0031412.P001, (5E)-5-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one, (5E)-5-{[5-(3-CHLORO-4-FLUOROPHENYL)FURAN-2-YL]METHYLIDENE}-3-(PROP-2-EN-1-YL)-2-SULFANYLIDENE-1,3-THIAZOLIDIN-4-ONE, (5E)-5-{[5-(3-chloro-4-fluorophenyl)furan-2-yl]methylidene}-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-4-one, (E)-3-allyl-5-((5-(3-chloro-4-fluorophenyl)furan-2-yl)methylene)-2-thioxothiazolidin-4-one
| Molecular Formula | C17H11ClFNO2S2 |
|---|---|
| Molecular Weight | 378.99 g/mol |
| LogP | 5.1263 |
| Topological Polar Surface Area | 33.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 378.9904 |
| Heavy Atoms | 24 |
| Complexity | 875.2255 |
Chemical Identifiers
| CAS Number | 299905-40-1 |
|---|---|
| SMILES | C=CCN1C(=O)/C(=C\C2=CC=C(O2)C3=CC(=C(C=C3)F)Cl)/SC1=S |
Product Overview
BIM-0031412.P001 (CAS 299905-40-1), with molecular formula C17H11ClFNO2S2 and molecular weight 378.99 g/mol. IUPAC: (5E)-5-[[5-(3-chloro-4-fluorophenyl)furan-2-yl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one.
Chemical Property Profile of BIM-0031412.P001
Property Insights of BIM-0031412.P001
The XLogP value of 5.1263 indicates that BIM-0031412.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.45 Ų, BIM-0031412.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0031412.P001 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0031412.P001?
The CAS number of BIM-0031412.P001 is 299905-40-1.
What is the molecular formula of BIM-0031412.P001?
The molecular formula of BIM-0031412.P001 is C17H11ClFNO2S2.
What is the molecular weight of BIM-0031412.P001?
The molecular weight of BIM-0031412.P001 is 378.99 g/mol.
Where can I buy BIM-0031412.P001?
You can request a quote for BIM-0031412.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0031412.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0031412.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.