N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide
TL;DR: N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide (CAS 56767-24-9) is a chemical compound with molecular formula C25H41NOS and molecular weight 403.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide
Also Known As: n-methyl-8-(3-octylthiiran-2-yl)-n-phenyloctanamide, 1-[(2,4-dimethylphenyl)methyl]-4-(4-fluorophenyl)piperazine
| Molecular Formula | C25H41NOS |
|---|---|
| Molecular Weight | 403.29 g/mol |
| LogP | 8.4 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 403.2909 |
| Heavy Atoms | 28 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 56767-24-9 |
|---|---|
| SMILES | CCCCCCCCC1C(S1)CCCCCCCC(=O)N(C)C2=CC=CC=C2 |
| InChIKey | GLJRFUSQOBKCMZ-UHFFFAOYSA-N |
Product Overview
N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide (CAS 56767-24-9), with molecular formula C25H41NOS and molecular weight 403.29 g/mol. IUPAC: N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide.
Chemical Property Profile of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide
Property Insights of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide
The XLogP value of 8.4 indicates that N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide?
The CAS number of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide is 56767-24-9.
What is the molecular formula of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide?
The molecular formula of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide is C25H41NOS.
What is the molecular weight of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide?
The molecular weight of N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide is 403.29 g/mol.
Where can I buy N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide?
You can request a quote for N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide?
Yes, KEHONG BIO provides custom synthesis services for N-methyl-8-(3-octylthiiran-2-yl)-N-phenyloctanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.