RefChem:339904
TL;DR: RefChem:339904 (CAS 95541-95-0) is a chemical compound with molecular formula C15H31NO3S and molecular weight 305.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-[[2-(1-ethylsulfanylpropan-2-yl)-2-methyl-1,3-dioxolan-4-yl]methoxymethyl]ethanamine
Also Known As: 2-Methyl-2-(1-methyl-2-ethylthioethyl)-4-dimethylaminomethoxymethyl-1,3-dioxolane, Ethanamine, N-ethyl-N-((2-((2-(2-ethylthio)-1-methylethyl)-2-methyl-1,3-dioxolan-4-yl)methoxy)methyl)-, N-ethyl-N-[({2-[1-(ethylsulfanyl)propan-2-yl]-2-methyl-1,3-dioxolan-4-yl}methoxy)methyl]ethanamine, N-ethyl-N-[[2-(1-ethylsulfanylpropan-2-yl)-2-methyl-1,3-dioxolan-4-yl]methoxymethyl]ethanamine, BRN 5517270
| Molecular Formula | C15H31NO3S |
|---|---|
| Molecular Weight | 305.20 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 56.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 305.20245 |
| Heavy Atoms | 20 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 95541-95-0 |
|---|---|
| SMILES | CCN(CC)COCC1COC(O1)(C)C(C)CSCC |
| InChIKey | GXIODGOVGNPWFG-UHFFFAOYSA-N |
Product Overview
RefChem:339904 (CAS 95541-95-0), with molecular formula C15H31NO3S and molecular weight 305.20 g/mol. IUPAC: N-ethyl-N-[[2-(1-ethylsulfanylpropan-2-yl)-2-methyl-1,3-dioxolan-4-yl]methoxymethyl]ethanamine.
Chemical Property Profile of RefChem:339904
Property Insights of RefChem:339904
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:339904. With a topological polar surface area (TPSA) of 56.2 Ų, RefChem:339904 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:339904 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:339904?
The CAS number of RefChem:339904 is 95541-95-0.
What is the molecular formula of RefChem:339904?
The molecular formula of RefChem:339904 is C15H31NO3S.
What is the molecular weight of RefChem:339904?
The molecular weight of RefChem:339904 is 305.20 g/mol.
Where can I buy RefChem:339904?
You can request a quote for RefChem:339904 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:339904?
Yes, KEHONG BIO provides custom synthesis services for RefChem:339904 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.