![(Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate structure](/static/products/845/845648-81-9.png)
(Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate
TL;DR: (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate (CAS 845648-81-9) is a chemical compound with molecular formula C23H19N5O6S and molecular weight 493.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(Z)-[5-imino-2-(2-morpholin-4-yl-2-oxoethyl)-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate
Also Known As: (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate, [4-[(Z)-[5-imino-2-(2-morpholin-4-yl-2-oxoethyl)-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate, 4-[(Z)-{5-imino-2-[2-(morpholin-4-yl)-2-oxoethyl]-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene}methyl]phenyl furan-2-carboxylate
| Molecular Formula | C23H19N5O6S |
|---|---|
| Molecular Weight | 493.11 g/mol |
| LogP | 2.36687 |
| Topological Polar Surface Area | 137.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 493.1056 |
| Heavy Atoms | 35 |
| Complexity | 1275.9801 |
Chemical Identifiers
| CAS Number | 845648-81-9 |
|---|---|
| SMILES | C1COCCN1C(=O)CC2=NN3C(=N)/C(=C/C4=CC=C(C=C4)OC(=O)C5=CC=CO5)/C(=O)N=C3S2 |
Product Overview
(Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate (CAS 845648-81-9), with molecular formula C23H19N5O6S and molecular weight 493.11 g/mol. IUPAC: [4-[(Z)-[5-imino-2-(2-morpholin-4-yl-2-oxoethyl)-7-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-ylidene]methyl]phenyl] furan-2-carboxylate.
Chemical Property Profile of (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate
Property Insights of (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate
The XLogP value of 2.36687 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate. The TPSA of 137.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate. Following Lipinski's Rule of Five, (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate has 1 hydrogen bond donor(s) and 9 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)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate?
The CAS number of (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate is 845648-81-9.
What is the molecular formula of (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate?
The molecular formula of (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate is C23H19N5O6S.
What is the molecular weight of (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate?
The molecular weight of (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate is 493.11 g/mol.
Where can I buy (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate?
You can request a quote for (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-((5-imino-2-(2-morpholino-2-oxoethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl)phenyl furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.