1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea
TL;DR: 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea (CAS 338962-73-5) is a chemical compound with molecular formula C14H12FIN4OS and molecular weight 429.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(3-fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea
Also Known As: 1-[[(3-fluorophenyl)methoxyamino]methylidene]-3-(5-iodopyridin-2-yl)thiourea, N-({[(3-fluorobenzyl)oxy]amino}methylene)-N'-(5-iodo-2-pyridinyl)thiourea, 1-[(1E)-{[(3-fluorophenyl)methoxy]amino}methylidene]-3-(5-iodopyridin-2-yl)thiourea
| Molecular Formula | C14H12FIN4OS |
|---|---|
| Molecular Weight | 429.98 g/mol |
| LogP | 3.2718 |
| Topological Polar Surface Area | 58.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.97607 |
| Heavy Atoms | 22 |
| Complexity | 666.14734 |
Chemical Identifiers
| CAS Number | 338962-73-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)CONC=NC(=S)NC2=NC=C(C=C2)I |
Product Overview
1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea (CAS 338962-73-5), with molecular formula C14H12FIN4OS and molecular weight 429.98 g/mol. IUPAC: 1-[[(3-fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea.
Chemical Property Profile of 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea
Property Insights of 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea
The XLogP value of 3.2718 indicates that 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.54 Ų, 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea has 2 hydrogen bond donor(s) and 3 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-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea?
The CAS number of 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea is 338962-73-5.
What is the molecular formula of 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea?
The molecular formula of 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea is C14H12FIN4OS.
What is the molecular weight of 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea?
The molecular weight of 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea is 429.98 g/mol.
Where can I buy 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea?
You can request a quote for 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[(3-Fluorophenyl)methoxyamino]methylidene]-3-(5-iodo-2-pyridinyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.