Carbamothioic acid, diethyl-
TL;DR: Carbamothioic acid, diethyl- (CAS 19045-48-8) is a chemical compound with molecular formula C5H11NOS and molecular weight 133.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethylcarbamothioic S-acid
Also Known As: diethylcarbamothioic S-acid, Carbamothioic acid, diethyl-, Diethylthiocarbamate, diethylthiocarbamic acid, diethyl-thiocarbamic acid
| Molecular Formula | C5H11NOS |
|---|---|
| Molecular Weight | 133.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 133.05614 |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 19045-48-8 |
|---|---|
| SMILES | CCN(CC)C(=O)S |
| InChIKey | UAGGVDVXSRGPRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbamothioic acid, diethyl- (CAS 19045-48-8), with molecular formula C5H11NOS and molecular weight 133.06 g/mol. IUPAC: diethylcarbamothioic S-acid.
Chemical Property Profile of Carbamothioic acid, diethyl-
Property Insights of Carbamothioic acid, diethyl-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamothioic acid, diethyl-. With a topological polar surface area (TPSA) of 21.3 Ų, Carbamothioic acid, diethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamothioic acid, diethyl- has 1 hydrogen bond donor(s) and 2 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 Carbamothioic acid, diethyl-?
The CAS number of Carbamothioic acid, diethyl- is 19045-48-8.
What is the molecular formula of Carbamothioic acid, diethyl-?
The molecular formula of Carbamothioic acid, diethyl- is C5H11NOS.
What is the molecular weight of Carbamothioic acid, diethyl-?
The molecular weight of Carbamothioic acid, diethyl- is 133.06 g/mol.
Where can I buy Carbamothioic acid, diethyl-?
You can request a quote for Carbamothioic acid, diethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamothioic acid, diethyl-?
Yes, KEHONG BIO provides custom synthesis services for Carbamothioic acid, diethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.