ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate
TL;DR: ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate (CAS 883023-83-4) is a chemical compound with molecular formula C10H16N4O2S and molecular weight 256.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate
Also Known As: ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate, ethyl N-{[3-(1H-imidazol-1-yl)propyl]carbamothioyl}carbamate
| Molecular Formula | C10H16N4O2S |
|---|---|
| Molecular Weight | 256.10 g/mol |
| LogP | 0.8938 |
| Topological Polar Surface Area | 68.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.0994 |
| Heavy Atoms | 17 |
| Complexity | 353.1977 |
Chemical Identifiers
| CAS Number | 883023-83-4 |
|---|---|
| SMILES | CCOC(=O)NC(=S)NCCCN1C=CN=C1 |
Product Overview
ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate (CAS 883023-83-4), with molecular formula C10H16N4O2S and molecular weight 256.10 g/mol. IUPAC: ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate.
Chemical Property Profile of ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate
Property Insights of ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate
The XLogP value of 0.8938 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate. The TPSA of 68.18 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate. Following Lipinski's Rule of Five, ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate has 2 hydrogen bond donor(s) and 4 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-(3-imidazol-1-ylpropylcarbamothioyl)carbamate?
The CAS number of ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate is 883023-83-4.
What is the molecular formula of ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate?
The molecular formula of ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate is C10H16N4O2S.
What is the molecular weight of ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate?
The molecular weight of ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate is 256.10 g/mol.
Where can I buy ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate?
You can request a quote for ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)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-(3-imidazol-1-ylpropylcarbamothioyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-(3-imidazol-1-ylpropylcarbamothioyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.