![3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea structure](/static/products/721/721908-05-0.png)
3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea
TL;DR: 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea (CAS 721908-05-0) is a chemical compound with molecular formula C16H16FN3O2S and molecular weight 333.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)-3-[(E)-(4-fluorophenyl)methylideneamino]thiourea
Also Known As: 1-(3,4-dimethoxyphenyl)-3-[(E)-(4-fluorophenyl)methylideneamino]thiourea, 3-(3,4-dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea
| Molecular Formula | C16H16FN3O2S |
|---|---|
| Molecular Weight | 333.09 g/mol |
| LogP | 3.1634 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.09473 |
| Heavy Atoms | 23 |
| Complexity | 704.97156 |
Chemical Identifiers
| CAS Number | 721908-05-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NC(=S)N/N=C/C2=CC=C(C=C2)F)OC |
Product Overview
3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea (CAS 721908-05-0), with molecular formula C16H16FN3O2S and molecular weight 333.09 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-3-[(E)-(4-fluorophenyl)methylideneamino]thiourea.
Chemical Property Profile of 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea
Property Insights of 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea
The XLogP value of 3.1634 indicates that 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea has 2 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 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea?
The CAS number of 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea is 721908-05-0.
What is the molecular formula of 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea?
The molecular formula of 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea is C16H16FN3O2S.
What is the molecular weight of 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea?
The molecular weight of 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea is 333.09 g/mol.
Where can I buy 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea?
You can request a quote for 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-Dimethoxyphenyl)-1-{[(4-fluorophenyl)methylidene]amino}thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.