ChemDiv1_023107
TL;DR: ChemDiv1_023107 (CAS 310447-05-3) is a chemical compound with molecular formula C17H17F6N3O2 and molecular weight 409.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)-6-piperidin-1-yl-4,4-bis(trifluoromethyl)-1,3,5-oxadiazine
Also Known As: ChemDiv1_023107, 2-(4-methoxyphenyl)-6-(piperidin-1-yl)-4,4-bis(trifluoromethyl)-4H-1,3,5-oxadiazine, A2298/0096866, 2-(4-METHOXYPHENYL)-6-(PIPERIDIN-1-YL)-4,4-BIS(TRIFLUOROMETHYL)-1,3,5-OXADIAZINE, 2-(4-methoxyphenyl)-6-piperidin-1-yl-4,4-bis(trifluoromethyl)-1,3,5-oxadiazine
| Molecular Formula | C17H17F6N3O2 |
|---|---|
| Molecular Weight | 409.12 g/mol |
| LogP | 4.1348 |
| Topological Polar Surface Area | 46.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 409.1225 |
| Heavy Atoms | 28 |
| Complexity | 750.58276 |
Chemical Identifiers
| CAS Number | 310447-05-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC(N=C(O2)N3CCCCC3)(C(F)(F)F)C(F)(F)F |
Product Overview
ChemDiv1_023107 (CAS 310447-05-3), with molecular formula C17H17F6N3O2 and molecular weight 409.12 g/mol. IUPAC: 2-(4-methoxyphenyl)-6-piperidin-1-yl-4,4-bis(trifluoromethyl)-1,3,5-oxadiazine.
Chemical Property Profile of ChemDiv1_023107
Property Insights of ChemDiv1_023107
The XLogP value of 4.1348 indicates that ChemDiv1_023107 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.42 Ų, ChemDiv1_023107 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_023107 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 ChemDiv1_023107?
The CAS number of ChemDiv1_023107 is 310447-05-3.
What is the molecular formula of ChemDiv1_023107?
The molecular formula of ChemDiv1_023107 is C17H17F6N3O2.
What is the molecular weight of ChemDiv1_023107?
The molecular weight of ChemDiv1_023107 is 409.12 g/mol.
Where can I buy ChemDiv1_023107?
You can request a quote for ChemDiv1_023107 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_023107?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_023107 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.