![(E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea structure](/static/products/858/858765-28-3.png)
(E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea
TL;DR: (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea (CAS 858765-28-3) is a chemical compound with molecular formula C14H19N3O4S and molecular weight 325.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea
Also Known As: (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea, 1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea
| Molecular Formula | C14H19N3O4S |
|---|---|
| Molecular Weight | 325.11 g/mol |
| LogP | 1.2106 |
| Topological Polar Surface Area | 75.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 325.10962 |
| Heavy Atoms | 22 |
| Complexity | 591.941 |
Chemical Identifiers
| CAS Number | 858765-28-3 |
|---|---|
| SMILES | CNC(=S)N(C)CCC1=CC2=C(C(=C1/C=N/O)OC)OCO2 |
Product Overview
(E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea (CAS 858765-28-3), with molecular formula C14H19N3O4S and molecular weight 325.11 g/mol. IUPAC: 1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea.
Chemical Property Profile of (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea
Property Insights of (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea
The XLogP value of 1.2106 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea. The TPSA of 75.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea. Following Lipinski's Rule of Five, (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea has 2 hydrogen bond donor(s) and 6 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 (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea?
The CAS number of (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea is 858765-28-3.
What is the molecular formula of (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea?
The molecular formula of (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea is C14H19N3O4S.
What is the molecular weight of (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea?
The molecular weight of (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea is 325.11 g/mol.
Where can I buy (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea?
You can request a quote for (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-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 (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(2-(6-((hydroxyimino)methyl)-7-methoxybenzo[d][1,3]dioxol-5-yl)ethyl)-1,3-dimethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.