BIM-0010453.P001
TL;DR: BIM-0010453.P001 (CAS 315244-45-2) is a chemical compound with molecular formula C18H13F3N2O2S3 and molecular weight 442.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
Also Known As: BIM-0010453.P001, 3-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide, 3-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide, (E)-3-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)-N-(3-(trifluoromethyl)phenyl)propanamide, 3-[(5E)-4-oxo-5-(2-thienylmethylene)-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
| Molecular Formula | C18H13F3N2O2S3 |
|---|---|
| Molecular Weight | 442.01 g/mol |
| LogP | 4.9969 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.00912 |
| Heavy Atoms | 28 |
| Complexity | 939.8025 |
Chemical Identifiers
| CAS Number | 315244-45-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)CCN2C(=O)/C(=C\C3=CC=CS3)/SC2=S)C(F)(F)F |
Product Overview
BIM-0010453.P001 (CAS 315244-45-2), with molecular formula C18H13F3N2O2S3 and molecular weight 442.01 g/mol. IUPAC: 3-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-[3-(trifluoromethyl)phenyl]propanamide.
Chemical Property Profile of BIM-0010453.P001
Property Insights of BIM-0010453.P001
The XLogP value of 4.9969 indicates that BIM-0010453.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BIM-0010453.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0010453.P001 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 BIM-0010453.P001?
The CAS number of BIM-0010453.P001 is 315244-45-2.
What is the molecular formula of BIM-0010453.P001?
The molecular formula of BIM-0010453.P001 is C18H13F3N2O2S3.
What is the molecular weight of BIM-0010453.P001?
The molecular weight of BIM-0010453.P001 is 442.01 g/mol.
Where can I buy BIM-0010453.P001?
You can request a quote for BIM-0010453.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0010453.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0010453.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.