1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea
TL;DR: 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea (CAS 338976-97-9) is a chemical compound with molecular formula C10H11Cl2N3OS and molecular weight 291.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(2,4-dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea
Also Known As: N-({[(2,4-dichlorobenzyl)oxy]imino}methyl)-N'-methylthiourea, 1-({[(2,4-dichlorophenyl)methoxy]imino}methyl)-3-methylthiourea, 1-[[(2,4-dichlorophenyl)methoxyamino]methylidene]-3-methyl-thiourea, 1-[[(2,4-dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea, 1-[(1Z)-{[(2,4-dichlorophenyl)methoxy]imino}methyl]-3-methylthiourea
| Molecular Formula | C10H11Cl2N3OS |
|---|---|
| Molecular Weight | 291.00 g/mol |
| LogP | 2.5472 |
| Topological Polar Surface Area | 45.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.0 |
| Heavy Atoms | 17 |
| Complexity | 426.0121 |
Chemical Identifiers
| CAS Number | 338976-97-9 |
|---|---|
| SMILES | CNC(=S)N=CNOCC1=C(C=C(C=C1)Cl)Cl |
Product Overview
1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea (CAS 338976-97-9), with molecular formula C10H11Cl2N3OS and molecular weight 291.00 g/mol. IUPAC: 1-[[(2,4-dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea.
Chemical Property Profile of 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea
Property Insights of 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea
The XLogP value of 2.5472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea. With a topological polar surface area (TPSA) of 45.65 Ų, 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea has 2 hydrogen bond donor(s) and 2 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-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea?
The CAS number of 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea is 338976-97-9.
What is the molecular formula of 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea?
The molecular formula of 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea is C10H11Cl2N3OS.
What is the molecular weight of 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea?
The molecular weight of 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea is 291.00 g/mol.
Where can I buy 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea?
You can request a quote for 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[(2,4-Dichlorophenyl)methoxyamino]methylidene]-3-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.