9M-717
TL;DR: 9M-717 (CAS 478246-01-4) is a chemical compound with molecular formula C18H18ClF3N2O2S and molecular weight 418.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-2-methylpropyl]-4-methoxybenzamide
Also Known As: 9M-717, N-(2-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-methylpropyl)-4-methoxybenzenecarboxamide, N-(2-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}-2-methylpropyl)-4-methoxybenzamide, N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-methylpropyl]-4-methoxybenzamide, N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-2-methyl-propyl]-4-methoxy-benzamide
| Molecular Formula | C18H18ClF3N2O2S |
|---|---|
| Molecular Weight | 418.07 g/mol |
| LogP | 5.0631 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.07297 |
| Heavy Atoms | 27 |
| Complexity | 811.2443 |
Chemical Identifiers
| CAS Number | 478246-01-4 |
|---|---|
| SMILES | CC(C)(CNC(=O)C1=CC=C(C=C1)OC)SC2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
9M-717 (CAS 478246-01-4), with molecular formula C18H18ClF3N2O2S and molecular weight 418.07 g/mol. IUPAC: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]-2-methylpropyl]-4-methoxybenzamide.
Chemical Property Profile of 9M-717
Property Insights of 9M-717
The XLogP value of 5.0631 indicates that 9M-717 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, 9M-717 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9M-717 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9M-717?
The CAS number of 9M-717 is 478246-01-4.
What is the molecular formula of 9M-717?
The molecular formula of 9M-717 is C18H18ClF3N2O2S.
What is the molecular weight of 9M-717?
The molecular weight of 9M-717 is 418.07 g/mol.
Where can I buy 9M-717?
You can request a quote for 9M-717 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9M-717?
Yes, KEHONG BIO provides custom synthesis services for 9M-717 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.