![3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide structure](/static/products/5912/591212-76-9.webp)
3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide
TL;DR: 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide (CAS 591212-76-9) is a chemical compound with molecular formula C22H18N4O5S2 and molecular weight 482.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[(2-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide
Also Known As: 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide, N-[5-[(2-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide
| Molecular Formula | C22H18N4O5S2 |
|---|---|
| Molecular Weight | 482.07 g/mol |
| LogP | 2.1228 |
| Topological Polar Surface Area | 113.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.07187 |
| Heavy Atoms | 33 |
| Complexity | 1399.2869 |
Chemical Identifiers
| CAS Number | 591212-76-9 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NN3C(=O)C(=CC4=C(C(=CC=C4)OC)O)SC3=S |
Product Overview
3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide (CAS 591212-76-9), with molecular formula C22H18N4O5S2 and molecular weight 482.07 g/mol. IUPAC: N-[5-[(2-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide.
Chemical Property Profile of 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide
Property Insights of 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide
The XLogP value of 2.1228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide. The TPSA of 113.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide. Following Lipinski's Rule of Five, 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide has 2 hydrogen bond donor(s) and 8 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 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide?
The CAS number of 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide is 591212-76-9.
What is the molecular formula of 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide?
The molecular formula of 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide is C22H18N4O5S2.
What is the molecular weight of 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide?
The molecular weight of 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide is 482.07 g/mol.
Where can I buy 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide?
You can request a quote for 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-N-[5-[(2-hydroxy-3-methoxyphenyl)methylene]-4-oxo-2-thioxo-3-thiazolidinyl]-3-methyl-4-oxo-1-phthalazineacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.