5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one
TL;DR: 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one (CAS 307495-38-1) is a chemical compound with molecular formula C15H17N3OS and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one
Also Known As: 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one, 3-((1H-benzo[d]imidazol-2-yl)thio)-4,6,6-trimethyl-5,6-dihydropyridin-2(1H)-one, 3-(1H-benzimidazol-2-ylsulfanyl)-4,6,6-trimethyl-5,6-dihydropyridin-2(1H)-one
| Molecular Formula | C15H17N3OS |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.10922 |
| Heavy Atoms | 20 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 307495-38-1 |
|---|---|
| SMILES | CC1=C(C(=O)NC(C1)(C)C)SC2=NC3=CC=CC=C3N2 |
| InChIKey | YZDHFFZRCRBQOY-UHFFFAOYSA-N |
Product Overview
5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one (CAS 307495-38-1), with molecular formula C15H17N3OS and molecular weight 287.11 g/mol. IUPAC: 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one.
Chemical Property Profile of 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one
Property Insights of 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one. Following Lipinski's Rule of Five, 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one has 2 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 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one?
The CAS number of 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one is 307495-38-1.
What is the molecular formula of 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one?
The molecular formula of 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one is C15H17N3OS.
What is the molecular weight of 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one?
The molecular weight of 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one is 287.11 g/mol.
Where can I buy 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one?
You can request a quote for 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(1H-benzimidazol-2-ylsulfanyl)-2,2,4-trimethyl-1,3-dihydropyridin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.