![5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one structure](/static/products/851/851622-55-4.png)
5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one
TL;DR: 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one (CAS 851622-55-4) is a chemical compound with molecular formula C21H24N4O3S2 and molecular weight 444.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one
Also Known As: 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one, 5,6-dimethyl-3-{[4-(2-phenylethenesulfonyl)piperazin-1-yl]methyl}-3H,4H-thieno[2,3-d]pyrimidin-4-one
| Molecular Formula | C21H24N4O3S2 |
|---|---|
| Molecular Weight | 444.13 g/mol |
| LogP | 2.65064 |
| Topological Polar Surface Area | 75.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 444.129 |
| Heavy Atoms | 30 |
| Complexity | 1238.4873 |
Chemical Identifiers
| CAS Number | 851622-55-4 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=O)N(C=N2)CN3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4)C |
Product Overview
5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one (CAS 851622-55-4), with molecular formula C21H24N4O3S2 and molecular weight 444.13 g/mol. IUPAC: 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one
Property Insights of 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one
The XLogP value of 2.65064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one. The TPSA of 75.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one. Following Lipinski's Rule of Five, 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one has 0 hydrogen bond donor(s) and 6 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 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one?
The CAS number of 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one is 851622-55-4.
What is the molecular formula of 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one?
The molecular formula of 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one is C21H24N4O3S2.
What is the molecular weight of 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one?
The molecular weight of 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one is 444.13 g/mol.
Where can I buy 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one?
You can request a quote for 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 5,6-dimethyl-3-[[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methyl]thieno[2,3-d]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.