DIOX2_006825
TL;DR: DIOX2_006825 (CAS 6087-20-3) is a chemical compound with molecular formula C32H40N4O5S and molecular weight 592.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-acetamido-N-[[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]methyl]hexanamide
Also Known As: DIOX2_006825, 6-acetamido-N-[[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]methyl]hexanamide, 6-Acetamido-N-{[4-(4-[4-(hydroxymethyl)phenyl]-5-methyl-6-{[(pyrimidin-2-yl)sulfanyl]methyl}-1,3-dioxan-2-yl)phenyl]methyl}hexanamide
| Molecular Formula | C32H40N4O5S |
|---|---|
| Molecular Weight | 592.27 g/mol |
| LogP | 4.8653 |
| Topological Polar Surface Area | 122.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 592.2719 |
| Heavy Atoms | 42 |
| Complexity | 1260.1624 |
Chemical Identifiers
| CAS Number | 6087-20-3 |
|---|---|
| SMILES | CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)CNC(=O)CCCCCNC(=O)C)CSC4=NC=CC=N4 |
Product Overview
DIOX2_006825 (CAS 6087-20-3), with molecular formula C32H40N4O5S and molecular weight 592.27 g/mol. IUPAC: 6-acetamido-N-[[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(pyrimidin-2-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]methyl]hexanamide.
Chemical Property Profile of DIOX2_006825
Property Insights of DIOX2_006825
The XLogP value of 4.8653 indicates that DIOX2_006825 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.67 Ų falls within the moderate polarity range, balancing permeability and solubility for DIOX2_006825. Following Lipinski's Rule of Five, DIOX2_006825 has 3 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 DIOX2_006825?
The CAS number of DIOX2_006825 is 6087-20-3.
What is the molecular formula of DIOX2_006825?
The molecular formula of DIOX2_006825 is C32H40N4O5S.
What is the molecular weight of DIOX2_006825?
The molecular weight of DIOX2_006825 is 592.27 g/mol.
Where can I buy DIOX2_006825?
You can request a quote for DIOX2_006825 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DIOX2_006825?
Yes, KEHONG BIO provides custom synthesis services for DIOX2_006825 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.