Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-
TL;DR: Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- (CAS 117269-55-3) is a chemical compound with molecular formula C14H17N3S and molecular weight 259.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-(4-pyrimidin-4-ylphenyl)sulfanylethanamine
Also Known As: 4-(4-SEtNMe2-Ph)Pyrimidine, Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-, 4-(((2-N,N-Dimethylaminoethyl)thio)phenyl)pyrimidine, 4-[((2-N,N-Dimethylaminoethyl)thio)phenyl]pyrimidine, Ethanamine,N,N-dimethyl-2-[[4-(4-pyrimidinyl)phenyl]thio]-
| Molecular Formula | C14H17N3S |
|---|---|
| Molecular Weight | 259.11 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 54.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 259.11432 |
| Heavy Atoms | 18 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 117269-55-3 |
|---|---|
| SMILES | CN(C)CCSC1=CC=C(C=C1)C2=NC=NC=C2 |
| InChIKey | HNPUZYTYTIYNIB-UHFFFAOYSA-N |
Product Overview
Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- (CAS 117269-55-3), with molecular formula C14H17N3S and molecular weight 259.11 g/mol. IUPAC: N,N-dimethyl-2-(4-pyrimidin-4-ylphenyl)sulfanylethanamine.
Chemical Property Profile of Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-
Property Insights of Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-. With a topological polar surface area (TPSA) of 54.3 Ų, Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- has 0 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 Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-?
The CAS number of Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- is 117269-55-3.
What is the molecular formula of Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-?
The molecular formula of Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- is C14H17N3S.
What is the molecular weight of Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-?
The molecular weight of Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- is 259.11 g/mol.
Where can I buy Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-?
You can request a quote for Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanamine, N,N-dimethyl-2-((4-(4-pyrimidinyl)phenyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.