N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide
TL;DR: N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide (CAS 335397-52-9) is a chemical compound with molecular formula C18H21NO2S and molecular weight 315.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-ethyl-2-methoxy-4-methylsulfanylbenzamide
Also Known As: BAS 02256954, N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide, BIM-0044303.P001, N-benzyl-N-ethyl-2-methoxy-4-(methylthio)benzamide, N-Benzyl-N-ethyl-2-methoxy-4-methylsulfanyl-benzamide
| Molecular Formula | C18H21NO2S |
|---|---|
| Molecular Weight | 315.13 g/mol |
| LogP | 4.0794 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.1293 |
| Heavy Atoms | 22 |
| Complexity | 628.2392 |
Chemical Identifiers
| CAS Number | 335397-52-9 |
|---|---|
| SMILES | CCN(CC1=CC=CC=C1)C(=O)C2=C(C=C(C=C2)SC)OC |
Product Overview
N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide (CAS 335397-52-9), with molecular formula C18H21NO2S and molecular weight 315.13 g/mol. IUPAC: N-benzyl-N-ethyl-2-methoxy-4-methylsulfanylbenzamide.
Chemical Property Profile of N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide
Property Insights of N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide
The XLogP value of 4.0794 indicates that N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide has 0 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 N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide?
The CAS number of N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide is 335397-52-9.
What is the molecular formula of N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide?
The molecular formula of N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide is C18H21NO2S.
What is the molecular weight of N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide?
The molecular weight of N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide is 315.13 g/mol.
Where can I buy N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide?
You can request a quote for N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-N-ethyl-2-methoxy-4-(methylsulfanyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.