1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene
TL;DR: 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene (CAS 338785-79-8) is a chemical compound with molecular formula C10H9Cl2N3OS and molecular weight 288.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-cyano-N-[(2,6-dichlorophenyl)methoxy]carbamimidothioate
Also Known As: 6F-020, methyl N'-cyano-N-[(2,6-dichlorophenyl)methoxy]carbamimidothioate, 1,3-dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene, (Z)-N'-cyano-N-[(2,6-dichlorophenyl)methoxy](methylsulfanyl)methanimidamide, N'-cyano-N-[(2,6-dichlorophenyl)methoxy]-1-methylsulfanyl-methanimidamide
| Molecular Formula | C10H9Cl2N3OS |
|---|---|
| Molecular Weight | 288.98 g/mol |
| LogP | 3.21468 |
| Topological Polar Surface Area | 57.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.98434 |
| Heavy Atoms | 17 |
| Complexity | 439.1045 |
Chemical Identifiers
| CAS Number | 338785-79-8 |
|---|---|
| SMILES | CSC(=NC#N)NOCC1=C(C=CC=C1Cl)Cl |
Product Overview
1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene (CAS 338785-79-8), with molecular formula C10H9Cl2N3OS and molecular weight 288.98 g/mol. IUPAC: methyl N'-cyano-N-[(2,6-dichlorophenyl)methoxy]carbamimidothioate.
Chemical Property Profile of 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene
Property Insights of 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene
The XLogP value of 3.21468 indicates that 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.41 Ų, 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene has 1 hydrogen bond donor(s) and 4 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 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene?
The CAS number of 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene is 338785-79-8.
What is the molecular formula of 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene?
The molecular formula of 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene is C10H9Cl2N3OS.
What is the molecular weight of 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene?
The molecular weight of 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene is 288.98 g/mol.
Where can I buy 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene?
You can request a quote for 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dichloro-2-[({[(cyanoimino)(methylsulfanyl)methyl]amino}oxy)methyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.