ChemDiv1_027247
TL;DR: ChemDiv1_027247 (CAS 3554-91-4) is a chemical compound with molecular formula C22H25NO6 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(8-hydroxy-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)acetamide
Also Known As: ChemDiv1_027247, 2-Ethoxy-4,6-difluoropyrimidine, 4CH-019391, N-TRIFLUOROACETYL-L-TYROSINEMETHYLESTER, BENZYL 2-ACETAMIDO-4,6-O-BENZYLIDENE-2-DEOXY-ALPHA-D-GLUCOPYRANOSIDE
| Molecular Formula | C22H25NO6 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 1.9079 |
| Topological Polar Surface Area | 86.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.16818 |
| Heavy Atoms | 29 |
| Complexity | 801.4645 |
Chemical Identifiers
| CAS Number | 3554-91-4 |
|---|---|
| SMILES | CC(=O)NC1C(C2C(COC(O2)C3=CC=CC=C3)OC1OCC4=CC=CC=C4)O |
Product Overview
ChemDiv1_027247 (CAS 3554-91-4), with molecular formula C22H25NO6 and molecular weight 399.17 g/mol. IUPAC: N-(8-hydroxy-2-phenyl-6-phenylmethoxy-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)acetamide.
Chemical Property Profile of ChemDiv1_027247
Property Insights of ChemDiv1_027247
The XLogP value of 1.9079 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_027247. The TPSA of 86.25 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_027247. Following Lipinski's Rule of Five, ChemDiv1_027247 has 2 hydrogen bond donor(s) and 6 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_027247?
The CAS number of ChemDiv1_027247 is 3554-91-4.
What is the molecular formula of ChemDiv1_027247?
The molecular formula of ChemDiv1_027247 is C22H25NO6.
What is the molecular weight of ChemDiv1_027247?
The molecular weight of ChemDiv1_027247 is 399.17 g/mol.
Where can I buy ChemDiv1_027247?
You can request a quote for ChemDiv1_027247 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_027247?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_027247 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.