RefChem:1086870
TL;DR: RefChem:1086870 (CAS 124041-19-6) is a chemical compound with molecular formula C22H28N6O2S2 and molecular weight 472.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-ethoxyphenyl)methyl]-3-[(E)-[(2E)-2-[(4-ethoxyphenyl)methylcarbamothioylhydrazinylidene]ethylidene]amino]thiourea
Also Known As: 2,2'-(1,2-Ethanediylidene)bis(N-((4-ethoxyphenyl)methyl)hydrazinecarbothioamide), Hydrazinecarbothioamide, 2,2'-(1,2-ethanediylidene)bis(N-((4-ethoxyphenyl)methyl)-, RefChem:1086870, BRN 3637967
| Molecular Formula | C22H28N6O2S2 |
|---|---|
| Molecular Weight | 472.17 g/mol |
| LogP | 3.084 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 472.1715 |
| Heavy Atoms | 32 |
| Complexity | 826.14197 |
Chemical Identifiers
| CAS Number | 124041-19-6 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)CNC(=S)N/N=C/C=N/NC(=S)NCC2=CC=C(C=C2)OCC |
Product Overview
RefChem:1086870 (CAS 124041-19-6), with molecular formula C22H28N6O2S2 and molecular weight 472.17 g/mol. IUPAC: 1-[(4-ethoxyphenyl)methyl]-3-[(E)-[(2E)-2-[(4-ethoxyphenyl)methylcarbamothioylhydrazinylidene]ethylidene]amino]thiourea.
Chemical Property Profile of RefChem:1086870
Property Insights of RefChem:1086870
The XLogP value of 3.084 indicates that RefChem:1086870 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1086870. Following Lipinski's Rule of Five, RefChem:1086870 has 4 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 RefChem:1086870?
The CAS number of RefChem:1086870 is 124041-19-6.
What is the molecular formula of RefChem:1086870?
The molecular formula of RefChem:1086870 is C22H28N6O2S2.
What is the molecular weight of RefChem:1086870?
The molecular weight of RefChem:1086870 is 472.17 g/mol.
Where can I buy RefChem:1086870?
You can request a quote for RefChem:1086870 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1086870?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1086870 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.