ethyl N-(tert-butylcarbamothioyl)carbamate
TL;DR: ethyl N-(tert-butylcarbamothioyl)carbamate (CAS 36997-93-0) is a chemical compound with molecular formula C8H16N2O2S and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(tert-butylcarbamothioyl)carbamate
Also Known As: ethyl N-(tert-butylcarbamothioyl)carbamate, N-(Ethoxycarbonyl)-N'-tert-butylthiourea, N-(Ethoxycarbonyl)-N -tert-butylthiourea, J1.608.588J
| Molecular Formula | C8H16N2O2S |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 1.4055 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.09325 |
| Heavy Atoms | 13 |
| Complexity | 198.81093 |
Chemical Identifiers
| CAS Number | 36997-93-0 |
|---|---|
| SMILES | CCOC(=O)NC(=S)NC(C)(C)C |
Product Overview
ethyl N-(tert-butylcarbamothioyl)carbamate (CAS 36997-93-0), with molecular formula C8H16N2O2S and molecular weight 204.09 g/mol. IUPAC: ethyl N-(tert-butylcarbamothioyl)carbamate.
Chemical Property Profile of ethyl N-(tert-butylcarbamothioyl)carbamate
Property Insights of ethyl N-(tert-butylcarbamothioyl)carbamate
The XLogP value of 1.4055 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-(tert-butylcarbamothioyl)carbamate. With a topological polar surface area (TPSA) of 50.36 Ų, ethyl N-(tert-butylcarbamothioyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl N-(tert-butylcarbamothioyl)carbamate 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 ethyl N-(tert-butylcarbamothioyl)carbamate?
The CAS number of ethyl N-(tert-butylcarbamothioyl)carbamate is 36997-93-0.
What is the molecular formula of ethyl N-(tert-butylcarbamothioyl)carbamate?
The molecular formula of ethyl N-(tert-butylcarbamothioyl)carbamate is C8H16N2O2S.
What is the molecular weight of ethyl N-(tert-butylcarbamothioyl)carbamate?
The molecular weight of ethyl N-(tert-butylcarbamothioyl)carbamate is 204.09 g/mol.
Where can I buy ethyl N-(tert-butylcarbamothioyl)carbamate?
You can request a quote for ethyl N-(tert-butylcarbamothioyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-(tert-butylcarbamothioyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-(tert-butylcarbamothioyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.