1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea
TL;DR: 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea (CAS 328070-09-3) is a chemical compound with molecular formula C10H22N2O2S and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,4-diethoxybutan-2-yl)-3-methylthiourea
Also Known As: 1-(4,4-diethoxybutan-2-yl)-3-methylthiourea
| Molecular Formula | C10H22N2O2S |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 1.258 |
| Topological Polar Surface Area | 42.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 234.1402 |
| Heavy Atoms | 15 |
| Complexity | 172.80533 |
Chemical Identifiers
| CAS Number | 328070-09-3 |
|---|---|
| SMILES | CCOC(CC(C)NC(=S)NC)OCC |
Product Overview
1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea (CAS 328070-09-3), with molecular formula C10H22N2O2S and molecular weight 234.14 g/mol. IUPAC: 1-(4,4-diethoxybutan-2-yl)-3-methylthiourea.
Chemical Property Profile of 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea
Property Insights of 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea
The XLogP value of 1.258 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea. With a topological polar surface area (TPSA) of 42.52 Ų, 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea has 2 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-(4,4-Diethoxybutan-2-yl)-3-methylthiourea?
The CAS number of 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea is 328070-09-3.
What is the molecular formula of 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea?
The molecular formula of 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea is C10H22N2O2S.
What is the molecular weight of 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea?
The molecular weight of 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea is 234.14 g/mol.
Where can I buy 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea?
You can request a quote for 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,4-Diethoxybutan-2-yl)-3-methylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.