![1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea structure](/static/products/833/833439-11-5.png)
1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea
TL;DR: 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea (CAS 833439-11-5) is a chemical compound with molecular formula C15H19FN2O2S2 and molecular weight 342.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,1-dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea
Also Known As: 1-(1,1-dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea, 1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-(2-fluorobenzyl)-3-prop-2-en-1-ylthiourea
| Molecular Formula | C15H19FN2O2S2 |
|---|---|
| Molecular Weight | 342.09 g/mol |
| LogP | 1.8753 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.0872 |
| Heavy Atoms | 22 |
| Complexity | 661.2612 |
Chemical Identifiers
| CAS Number | 833439-11-5 |
|---|---|
| SMILES | C=CCNC(=S)N(CC1=CC=CC=C1F)C2CCS(=O)(=O)C2 |
Product Overview
1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea (CAS 833439-11-5), with molecular formula C15H19FN2O2S2 and molecular weight 342.09 g/mol. IUPAC: 1-(1,1-dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea.
Chemical Property Profile of 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea
Property Insights of 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea
The XLogP value of 1.8753 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea. With a topological polar surface area (TPSA) of 49.41 Ų, 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea has 1 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-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea?
The CAS number of 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea is 833439-11-5.
What is the molecular formula of 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea?
The molecular formula of 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea is C15H19FN2O2S2.
What is the molecular weight of 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea?
The molecular weight of 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea is 342.09 g/mol.
Where can I buy 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea?
You can request a quote for 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,1-Dioxothiolan-3-yl)-1-[(2-fluorophenyl)methyl]-3-prop-2-enylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.