SYN 2921
TL;DR: SYN 2921 (CAS 227103-93-7) is a chemical compound with molecular formula C32H30F6N8O3 and molecular weight 688.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[4-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl]-3-fluorophenyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-1,2,4-triazol-3-one
Also Known As: SYN 2921, 3H-1,2,4-Triazol-3-one, 4-(4-(4-((1R,2R)-2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1H-1,2,4-triazol-1-yl)propyl)-1-piperazinyl)-3-fluorophenyl)-2,4-dihydro-2-((4-(trifluoromethoxy)phenyl)methyl)-, 4-(4-{4-[(2R,3R)-3-(2,4-Difluorophenyl)-3-hydroxy-4-(1H-1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl}-3-fluorophenyl)-2-{[4-(trifluoromethoxy)phenyl]methyl}-2,4-dihydro-3H-1,2,4-triazol-3-one, 4-[4-[4-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl]-3-fluorophenyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-1,2,4-triazol-3-one
| Molecular Formula | C32H30F6N8O3 |
|---|---|
| Molecular Weight | 688.23 g/mol |
| LogP | 4.0882 |
| Topological Polar Surface Area | 106.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 688.2345 |
| Heavy Atoms | 49 |
| Complexity | 1956.8737 |
Chemical Identifiers
| CAS Number | 227103-93-7 |
|---|---|
| SMILES | C[C@H]([C@](CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3CCN(CC3)C4=C(C=C(C=C4)N5C=NN(C5=O)CC6=CC=C(C=C6)OC(F)(F)F)F |
Product Overview
SYN 2921 (CAS 227103-93-7), with molecular formula C32H30F6N8O3 and molecular weight 688.23 g/mol. IUPAC: 4-[4-[4-[(2R,3R)-3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]piperazin-1-yl]-3-fluorophenyl]-2-[[4-(trifluoromethoxy)phenyl]methyl]-1,2,4-triazol-3-one.
Chemical Property Profile of SYN 2921
Property Insights of SYN 2921
The XLogP value of 4.0882 indicates that SYN 2921 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.47 Ų falls within the moderate polarity range, balancing permeability and solubility for SYN 2921. Following Lipinski's Rule of Five, SYN 2921 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SYN 2921?
The CAS number of SYN 2921 is 227103-93-7.
What is the molecular formula of SYN 2921?
The molecular formula of SYN 2921 is C32H30F6N8O3.
What is the molecular weight of SYN 2921?
The molecular weight of SYN 2921 is 688.23 g/mol.
Where can I buy SYN 2921?
You can request a quote for SYN 2921 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SYN 2921?
Yes, KEHONG BIO provides custom synthesis services for SYN 2921 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.