RefChem:339903
TL;DR: RefChem:339903 (CAS 95541-96-1) is a chemical compound with molecular formula C16H33NO3S and molecular weight 319.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-[[2-methyl-2-(1-propylsulfanylpropan-2-yl)-1,3-dioxolan-4-yl]methoxymethyl]ethanamine
Also Known As: Ethanamine, N-ethyl-N-(((2-methyl-2-(1-methyl-2-(propylthio)ethyl)-1,3-dioxolan-4-yl)methoxy)methyl)-, 2-Methyl-2-(1-methyl-2-(propylthio)ethyl-4-diethylaminomethoxymethyl)-1,3-dioxolane, N-ETHYL-N-(((2-METHYL-2-(1-METHYL-2-(PROPYLTHIO)ETHYL)-1,3-DIOXOLAN-4-YL)METHOXY)METHYL)ETHANAMINE, N-Ethyl-N-[({2-methyl-2-[1-(propylsulfanyl)propan-2-yl]-1,3-dioxolan-4-yl}methoxy)methyl]ethanamine, N-ethyl-N-[[2-methyl-2-(1-propylsulfanylpropan-2-yl)-1,3-dioxolan-4-yl]methoxymethyl]ethanamine
| Molecular Formula | C16H33NO3S |
|---|---|
| Molecular Weight | 319.22 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 319.2181 |
| Heavy Atoms | 21 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 95541-96-1 |
|---|---|
| SMILES | CCCSCC(C)C1(OCC(O1)COCN(CC)CC)C |
| InChIKey | DEUXYGSFWMHWSI-UHFFFAOYSA-N |
Product Overview
RefChem:339903 (CAS 95541-96-1), with molecular formula C16H33NO3S and molecular weight 319.22 g/mol. IUPAC: N-ethyl-N-[[2-methyl-2-(1-propylsulfanylpropan-2-yl)-1,3-dioxolan-4-yl]methoxymethyl]ethanamine.
Chemical Property Profile of RefChem:339903
Property Insights of RefChem:339903
The XLogP value of 3.2 indicates that RefChem:339903 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.2 Ų, RefChem:339903 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:339903 has 0 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 RefChem:339903?
The CAS number of RefChem:339903 is 95541-96-1.
What is the molecular formula of RefChem:339903?
The molecular formula of RefChem:339903 is C16H33NO3S.
What is the molecular weight of RefChem:339903?
The molecular weight of RefChem:339903 is 319.22 g/mol.
Where can I buy RefChem:339903?
You can request a quote for RefChem:339903 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:339903?
Yes, KEHONG BIO provides custom synthesis services for RefChem:339903 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.