2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine
TL;DR: 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine (CAS 303149-07-7) is a chemical compound with molecular formula C17H19F3N2OS and molecular weight 356.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanyl-4,4-dimethyl-6-[2-[4-(trifluoromethoxy)phenyl]ethenyl]-1H-pyrimidine
Also Known As: 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine, 2-ethylsulfanyl-4,4-dimethyl-6-[2-[4-(trifluoromethoxy)phenyl]ethenyl]-1H-pyrimidine
| Molecular Formula | C17H19F3N2OS |
|---|---|
| Molecular Weight | 356.12 g/mol |
| LogP | 4.9732 |
| Topological Polar Surface Area | 33.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.117 |
| Heavy Atoms | 24 |
| Complexity | 661.4084 |
Chemical Identifiers
| CAS Number | 303149-07-7 |
|---|---|
| SMILES | CCSC1=NC(C=C(N1)C=CC2=CC=C(C=C2)OC(F)(F)F)(C)C |
Product Overview
2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine (CAS 303149-07-7), with molecular formula C17H19F3N2OS and molecular weight 356.12 g/mol. IUPAC: 2-ethylsulfanyl-4,4-dimethyl-6-[2-[4-(trifluoromethoxy)phenyl]ethenyl]-1H-pyrimidine.
Chemical Property Profile of 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine
Property Insights of 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine
The XLogP value of 4.9732 indicates that 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.62 Ų, 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine has 1 hydrogen bond donor(s) and 4 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-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine?
The CAS number of 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine is 303149-07-7.
What is the molecular formula of 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine?
The molecular formula of 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine is C17H19F3N2OS.
What is the molecular weight of 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine?
The molecular weight of 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine is 356.12 g/mol.
Where can I buy 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine?
You can request a quote for 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(ethylsulfanyl)-6,6-dimethyl-4-[4-(trifluoromethoxy)styryl]-1,6-dihydropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.