![1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea structure](/static/products/858/858769-52-5.png)
1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea
TL;DR: 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea (CAS 858769-52-5) is a chemical compound with molecular formula C14H18N2O4S and molecular weight 310.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea
Also Known As: 1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea, 1-(2-(6-formyl-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea
| Molecular Formula | C14H18N2O4S |
|---|---|
| Molecular Weight | 310.10 g/mol |
| LogP | 1.215 |
| Topological Polar Surface Area | 60.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 310.09872 |
| Heavy Atoms | 21 |
| Complexity | 562.39526 |
Chemical Identifiers
| CAS Number | 858769-52-5 |
|---|---|
| SMILES | CNC(=S)N(C)CCC1=CC2=C(C(=C1C=O)OC)OCO2 |
Product Overview
1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea (CAS 858769-52-5), with molecular formula C14H18N2O4S and molecular weight 310.10 g/mol. IUPAC: 1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea.
Chemical Property Profile of 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea
Property Insights of 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea
The XLogP value of 1.215 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea. The TPSA of 60.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea. Following Lipinski's Rule of Five, 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea 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-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea?
The CAS number of 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea is 858769-52-5.
What is the molecular formula of 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea?
The molecular formula of 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea is C14H18N2O4S.
What is the molecular weight of 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea?
The molecular weight of 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea is 310.10 g/mol.
Where can I buy 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea?
You can request a quote for 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(6-Formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1,3-dimethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.