![2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide structure](/static/products/360/360563-15-1.png)
2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide
TL;DR: 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide (CAS 360563-15-1) is a chemical compound with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]acetamide
Also Known As: 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide, 2-[(5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]acetamide, 2-((5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)thio)acetamide, 2-[(5-BENZOYL-3-CYANO-4,6-DIMETHYL-1,4-DIHYDRO-2-PYRIDINYL)SULFANYL]ACETAMIDE
| Molecular Formula | C17H17N3O2S |
|---|---|
| Molecular Weight | 327.10 g/mol |
| LogP | 2.33628 |
| Topological Polar Surface Area | 95.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.10416 |
| Heavy Atoms | 23 |
| Complexity | 744.85205 |
Chemical Identifiers
| CAS Number | 360563-15-1 |
|---|---|
| SMILES | CC1C(=C(NC(=C1C(=O)C2=CC=CC=C2)C)SCC(=O)N)C#N |
Product Overview
2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide (CAS 360563-15-1), with molecular formula C17H17N3O2S and molecular weight 327.10 g/mol. IUPAC: 2-[(5-benzoyl-3-cyano-4,6-dimethyl-1,4-dihydropyridin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide
Property Insights of 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide
The XLogP value of 2.33628 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide. The TPSA of 95.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide. Following Lipinski's Rule of Five, 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide has 2 hydrogen bond donor(s) and 5 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-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide?
The CAS number of 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide is 360563-15-1.
What is the molecular formula of 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide?
The molecular formula of 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide is C17H17N3O2S.
What is the molecular weight of 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide?
The molecular weight of 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide is 327.10 g/mol.
Where can I buy 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide?
You can request a quote for 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[3-cyano-4,6-dimethyl-5-(phenylcarbonyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.