IDI1_010522
TL;DR: IDI1_010522 (CAS 1164517-60-5) is a chemical compound with molecular formula C22H18N2O3S2 and molecular weight 422.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-naphthalen-2-ylbutanamide
Also Known As: IDI1_010522, (E)-4-(5-(furan-2-ylmethylene)-4-oxo-2-thioxothiazolidin-3-yl)-N-(naphthalen-2-yl)butanamide, 4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-naphthalen-2-ylbutanamide, 4-[(5E)-5-[(furan-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-(naphthalen-2-yl)butanamide, 4-[5-(2-furylmethylene)-4-oxo-2-thioxo(1,3-thiazolidin-3-yl)]-N-(2-naphthyl)bu tanamide
| Molecular Formula | C22H18N2O3S2 |
|---|---|
| Molecular Weight | 422.08 g/mol |
| LogP | 5.0529 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 422.0759 |
| Heavy Atoms | 29 |
| Complexity | 1106.2075 |
Chemical Identifiers
| CAS Number | 1164517-60-5 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)NC(=O)CCCN3C(=O)/C(=C\C4=CC=CO4)/SC3=S |
Product Overview
IDI1_010522 (CAS 1164517-60-5), with molecular formula C22H18N2O3S2 and molecular weight 422.08 g/mol. IUPAC: 4-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-N-naphthalen-2-ylbutanamide.
Chemical Property Profile of IDI1_010522
Property Insights of IDI1_010522
The XLogP value of 5.0529 indicates that IDI1_010522 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for IDI1_010522. Following Lipinski's Rule of Five, IDI1_010522 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of IDI1_010522?
The CAS number of IDI1_010522 is 1164517-60-5.
What is the molecular formula of IDI1_010522?
The molecular formula of IDI1_010522 is C22H18N2O3S2.
What is the molecular weight of IDI1_010522?
The molecular weight of IDI1_010522 is 422.08 g/mol.
Where can I buy IDI1_010522?
You can request a quote for IDI1_010522 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IDI1_010522?
Yes, KEHONG BIO provides custom synthesis services for IDI1_010522 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.