2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd
TL;DR: 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd (CAS 74170-66-4) is a chemical compound with molecular formula C12H17NO3S and molecular weight 255.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihydro-2H-pyridin-1-yl)ethanone
Also Known As: 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd, 2-[2-(6-Methyl-3,4-dihydropyridin-1(2H)-yl)-2-oxoethyl]-2,5-dihydro-1H-1lambda~6~-thiophene-1,1-dione, 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihydro-2H-pyridin-1-yl)ethanone
| Molecular Formula | C12H17NO3S |
|---|---|
| Molecular Weight | 255.09 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.09291 |
| Heavy Atoms | 17 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 74170-66-4 |
|---|---|
| SMILES | CC1=CCCCN1C(=O)CC2C=CCS2(=O)=O |
| InChIKey | QBPPNSDLDBPMRY-UHFFFAOYSA-N |
Product Overview
2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd (CAS 74170-66-4), with molecular formula C12H17NO3S and molecular weight 255.09 g/mol. IUPAC: 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihydro-2H-pyridin-1-yl)ethanone.
Chemical Property Profile of 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd
Property Insights of 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd. Following Lipinski's Rule of Five, 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd has 0 hydrogen bond donor(s) and 3 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 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd?
The CAS number of 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd is 74170-66-4.
What is the molecular formula of 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd?
The molecular formula of 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd is C12H17NO3S.
What is the molecular weight of 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd?
The molecular weight of 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd is 255.09 g/mol.
Where can I buy 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd?
You can request a quote for 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,1-dioxo-2,5-dihydrothiophen-2-yl)-1-(6-methyl-3,4-dihyd and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.