Isoxyl
TL;DR: Isoxyl (CAS 910-86-1) is a chemical compound with molecular formula C23H32N2O2S and molecular weight 400.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis[4-(3-methylbutoxy)phenyl]thiourea
Also Known As: Isoxyl, Tiocarlide, Thiocarlide, Tiocarlid, Tiocarlida
| Molecular Formula | C23H32N2O2S |
|---|---|
| Molecular Weight | 400.22 g/mol |
| LogP | 6.3453 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 400.21844 |
| Heavy Atoms | 28 |
| Complexity | 650.8871 |
Chemical Identifiers
| CAS Number | 910-86-1 |
|---|---|
| SMILES | CC(C)CCOC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OCCC(C)C |
Product Overview
Isoxyl (CAS 910-86-1), with molecular formula C23H32N2O2S and molecular weight 400.22 g/mol. IUPAC: 1,3-bis[4-(3-methylbutoxy)phenyl]thiourea.
Chemical Property Profile of Isoxyl
Property Insights of Isoxyl
The XLogP value of 6.3453 indicates that Isoxyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.52 Ų, Isoxyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoxyl has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isoxyl?
The CAS number of Isoxyl is 910-86-1.
What is the molecular formula of Isoxyl?
The molecular formula of Isoxyl is C23H32N2O2S.
What is the molecular weight of Isoxyl?
The molecular weight of Isoxyl is 400.22 g/mol.
Where can I buy Isoxyl?
You can request a quote for Isoxyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxyl?
Yes, KEHONG BIO provides custom synthesis services for Isoxyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.