BIM-0031817.P001
TL;DR: BIM-0031817.P001 (CAS 301692-10-4) is a chemical compound with molecular formula C20H18N2O3S2 and molecular weight 398.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5E)-5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-methylbenzamide
Also Known As: BIM-0031817.P001, AB00095994-01, N-[(5E)-5-(2-ethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-2-methylbenzamide, N-[(5E)-5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-methylbenzamide, (E)-N-(5-(2-ethoxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)-2-methylbenzamide
| Molecular Formula | C20H18N2O3S2 |
|---|---|
| Molecular Weight | 398.08 g/mol |
| LogP | 3.93992 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.0759 |
| Heavy Atoms | 27 |
| Complexity | 940.329 |
Chemical Identifiers
| CAS Number | 301692-10-4 |
|---|---|
| SMILES | CCOC1=CC=CC=C1/C=C/2\C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3C |
Product Overview
BIM-0031817.P001 (CAS 301692-10-4), with molecular formula C20H18N2O3S2 and molecular weight 398.08 g/mol. IUPAC: N-[(5E)-5-[(2-ethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-methylbenzamide.
Chemical Property Profile of BIM-0031817.P001
Property Insights of BIM-0031817.P001
The XLogP value of 3.93992 indicates that BIM-0031817.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, BIM-0031817.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0031817.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-0031817.P001?
The CAS number of BIM-0031817.P001 is 301692-10-4.
What is the molecular formula of BIM-0031817.P001?
The molecular formula of BIM-0031817.P001 is C20H18N2O3S2.
What is the molecular weight of BIM-0031817.P001?
The molecular weight of BIM-0031817.P001 is 398.08 g/mol.
Where can I buy BIM-0031817.P001?
You can request a quote for BIM-0031817.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0031817.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0031817.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.