IDI1_010388
TL;DR: IDI1_010388 (CAS 613225-41-5) is a chemical compound with molecular formula C17H12N2O4S3 and molecular weight 404.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]acetamide
Also Known As: IDI1_010388, IDI1_019140, F1063-1735, (E)-N-(benzo[d][1,3]dioxol-5-yl)-2-(4-oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)acetamide, N-(2H-1,3-benzodioxol-5-yl)-2-[(5E)-4-oxo-2-sulfanylidene-5-[(thiophen-2-yl)methylidene]-1,3-thiazolidin-3-yl]acetamide
| Molecular Formula | C17H12N2O4S3 |
|---|---|
| Molecular Weight | 404.00 g/mol |
| LogP | 3.3167 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.9959 |
| Heavy Atoms | 26 |
| Complexity | 924.0941 |
Chemical Identifiers
| CAS Number | 613225-41-5 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)CN3C(=O)/C(=C\C4=CC=CS4)/SC3=S |
Product Overview
IDI1_010388 (CAS 613225-41-5), with molecular formula C17H12N2O4S3 and molecular weight 404.00 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]acetamide.
Chemical Property Profile of IDI1_010388
Property Insights of IDI1_010388
The XLogP value of 3.3167 indicates that IDI1_010388 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for IDI1_010388. Following Lipinski's Rule of Five, IDI1_010388 has 1 hydrogen bond donor(s) and 7 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 IDI1_010388?
The CAS number of IDI1_010388 is 613225-41-5.
What is the molecular formula of IDI1_010388?
The molecular formula of IDI1_010388 is C17H12N2O4S3.
What is the molecular weight of IDI1_010388?
The molecular weight of IDI1_010388 is 404.00 g/mol.
Where can I buy IDI1_010388?
You can request a quote for IDI1_010388 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IDI1_010388?
Yes, KEHONG BIO provides custom synthesis services for IDI1_010388 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.