SAH1_000104
TL;DR: SAH1_000104 (CAS 6103-13-5) is a chemical compound with molecular formula C22H26F3IN2O5 and molecular weight 582.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)-5-[pent-2-enoyl(2,2,2-trifluoroethyl)amino]cyclohexene-1-carboxamide
Also Known As: SAH1_000104, 4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)-5-[pent-2-enoyl(2,2,2-trifluoroethyl)amino]cyclohexene-1-carboxamide, 4-Hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)-5-[N-(2,2,2-trifluoroethyl)pent-2-enamido]cyclohex-1-ene-1-carboxamide
| Molecular Formula | C22H26F3IN2O5 |
|---|---|
| Molecular Weight | 582.08 g/mol |
| LogP | 2.5638 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 582.08386 |
| Heavy Atoms | 33 |
| Complexity | 891.0274 |
Chemical Identifiers
| CAS Number | 6103-13-5 |
|---|---|
| SMILES | CCC=CC(=O)N(CC(F)(F)F)C1CC(=CC(C1O)OC2=CC=CC=C2I)C(=O)NCCO |
Product Overview
SAH1_000104 (CAS 6103-13-5), with molecular formula C22H26F3IN2O5 and molecular weight 582.08 g/mol. IUPAC: 4-hydroxy-N-(2-hydroxyethyl)-3-(2-iodophenoxy)-5-[pent-2-enoyl(2,2,2-trifluoroethyl)amino]cyclohexene-1-carboxamide.
Chemical Property Profile of SAH1_000104
Property Insights of SAH1_000104
The XLogP value of 2.5638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SAH1_000104. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for SAH1_000104. Following Lipinski's Rule of Five, SAH1_000104 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SAH1_000104?
The CAS number of SAH1_000104 is 6103-13-5.
What is the molecular formula of SAH1_000104?
The molecular formula of SAH1_000104 is C22H26F3IN2O5.
What is the molecular weight of SAH1_000104?
The molecular weight of SAH1_000104 is 582.08 g/mol.
Where can I buy SAH1_000104?
You can request a quote for SAH1_000104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SAH1_000104?
Yes, KEHONG BIO provides custom synthesis services for SAH1_000104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.