6E-016
TL;DR: 6E-016 (CAS 338780-70-4) is a chemical compound with molecular formula C15H18ClF3N4O and molecular weight 362.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(dimethylaminomethylidene)piperidine-4-carboxamide
Also Known As: 6E-016, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-[(dimethylamino)methylene]-4-piperidinecarboxamide, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(dimethylaminomethylidene)piperidine-4-carboxamide, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-[(1E)-(dimethylamino)methylidene]piperidine-4-carboxamide
| Molecular Formula | C15H18ClF3N4O |
|---|---|
| Molecular Weight | 362.11 g/mol |
| LogP | 3.0867 |
| Topological Polar Surface Area | 48.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.11212 |
| Heavy Atoms | 24 |
| Complexity | 625.63544 |
Chemical Identifiers
| CAS Number | 338780-70-4 |
|---|---|
| SMILES | CN(C)C=NC(=O)C1CCN(CC1)C2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
6E-016 (CAS 338780-70-4), with molecular formula C15H18ClF3N4O and molecular weight 362.11 g/mol. IUPAC: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(dimethylaminomethylidene)piperidine-4-carboxamide.
Chemical Property Profile of 6E-016
Property Insights of 6E-016
The XLogP value of 3.0867 indicates that 6E-016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.8 Ų, 6E-016 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6E-016 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 6E-016?
The CAS number of 6E-016 is 338780-70-4.
What is the molecular formula of 6E-016?
The molecular formula of 6E-016 is C15H18ClF3N4O.
What is the molecular weight of 6E-016?
The molecular weight of 6E-016 is 362.11 g/mol.
Where can I buy 6E-016?
You can request a quote for 6E-016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6E-016?
Yes, KEHONG BIO provides custom synthesis services for 6E-016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.