![1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea structure](/static/products/833/833433-18-4.png)
1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea
TL;DR: 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea (CAS 833433-18-4) is a chemical compound with molecular formula C17H24N2O4S2 and molecular weight 384.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea
Also Known As: AS-871/43478105, 1-[(3,4-dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea, 1-(3,4-dimethoxybenzyl)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-prop-2-en-1-ylthiourea, N'-allyl-N-(3,4-dimethoxybenzyl)-N-(1,1-dioxidotetrahydro-3-thienyl)thiourea
| Molecular Formula | C17H24N2O4S2 |
|---|---|
| Molecular Weight | 384.12 g/mol |
| LogP | 1.7534 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 384.11774 |
| Heavy Atoms | 25 |
| Complexity | 734.16345 |
Chemical Identifiers
| CAS Number | 833433-18-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=S)NCC=C)OC |
Product Overview
1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea (CAS 833433-18-4), with molecular formula C17H24N2O4S2 and molecular weight 384.12 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea.
Chemical Property Profile of 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea
Property Insights of 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea
The XLogP value of 1.7534 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea. Following Lipinski's Rule of Five, 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea has 1 hydrogen bond donor(s) and 5 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-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea?
The CAS number of 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea is 833433-18-4.
What is the molecular formula of 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea?
The molecular formula of 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea is C17H24N2O4S2.
What is the molecular weight of 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea?
The molecular weight of 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea is 384.12 g/mol.
Where can I buy 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea?
You can request a quote for 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-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-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3,4-Dimethoxyphenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-3-prop-2-enylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.