![(Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate structure](/static/products/620/620540-57-0.png)
(Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate
TL;DR: (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate (CAS 620540-57-0) is a chemical compound with molecular formula C24H21N3O5S and molecular weight 463.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(Z)-[3,7-dioxo-6-[(4-propoxyphenyl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazin-2-ylidene]methyl]benzoate
Also Known As: (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate, methyl 4-[(Z)-[3,7-dioxo-6-[(4-propoxyphenyl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazin-2-ylidene]methyl]benzoate
| Molecular Formula | C24H21N3O5S |
|---|---|
| Molecular Weight | 463.12 g/mol |
| LogP | 2.2251 |
| Topological Polar Surface Area | 99.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.12018 |
| Heavy Atoms | 33 |
| Complexity | 1457.7499 |
Chemical Identifiers
| CAS Number | 620540-57-0 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)CC2=NN3C(=O)/C(=C/C4=CC=C(C=C4)C(=O)OC)/SC3=NC2=O |
Product Overview
(Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate (CAS 620540-57-0), with molecular formula C24H21N3O5S and molecular weight 463.12 g/mol. IUPAC: methyl 4-[(Z)-[3,7-dioxo-6-[(4-propoxyphenyl)methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazin-2-ylidene]methyl]benzoate.
Chemical Property Profile of (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate
Property Insights of (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate
The XLogP value of 2.2251 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate. The TPSA of 99.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate. Following Lipinski's Rule of Five, (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate has 0 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 (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate?
The CAS number of (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate is 620540-57-0.
What is the molecular formula of (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate?
The molecular formula of (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate is C24H21N3O5S.
What is the molecular weight of (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate?
The molecular weight of (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate is 463.12 g/mol.
Where can I buy (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate?
You can request a quote for (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-methyl 4-((3,7-dioxo-6-(4-propoxybenzyl)-3,7-dihydro-2H-thiazolo[3,2-b][1,2,4]triazin-2-ylidene)methyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.