DIOX2_001708
TL;DR: DIOX2_001708 (CAS 6087-81-6) is a chemical compound with molecular formula C34H35N5O5S2 and molecular weight 657.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzenesulfonamide
Also Known As: DIOX2_001708, N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzenesulfonamide, N-{[3'-(4-[4-(Hydroxymethyl)phenyl]-5-methyl-6-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,3-dioxan-2-yl)[1,1'-biphenyl]-3-yl]methyl}benzenesulfonamide
| Molecular Formula | C34H35N5O5S2 |
|---|---|
| Molecular Weight | 657.21 g/mol |
| LogP | 5.4316 |
| Topological Polar Surface Area | 128.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 657.20795 |
| Heavy Atoms | 46 |
| Complexity | 1868.6439 |
Chemical Identifiers
| CAS Number | 6087-81-6 |
|---|---|
| SMILES | CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=CC(=C3)C4=CC=CC(=C4)CNS(=O)(=O)C5=CC=CC=C5)CSC6=NN=NN6C |
Product Overview
DIOX2_001708 (CAS 6087-81-6), with molecular formula C34H35N5O5S2 and molecular weight 657.21 g/mol. IUPAC: N-[[3-[3-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzenesulfonamide.
Chemical Property Profile of DIOX2_001708
Property Insights of DIOX2_001708
The XLogP value of 5.4316 indicates that DIOX2_001708 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.46 Ų falls within the moderate polarity range, balancing permeability and solubility for DIOX2_001708. Following Lipinski's Rule of Five, DIOX2_001708 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of DIOX2_001708?
The CAS number of DIOX2_001708 is 6087-81-6.
What is the molecular formula of DIOX2_001708?
The molecular formula of DIOX2_001708 is C34H35N5O5S2.
What is the molecular weight of DIOX2_001708?
The molecular weight of DIOX2_001708 is 657.21 g/mol.
Where can I buy DIOX2_001708?
You can request a quote for DIOX2_001708 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DIOX2_001708?
Yes, KEHONG BIO provides custom synthesis services for DIOX2_001708 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.