N-(diethylcarbamothioyl)benzamide
TL;DR: N-(diethylcarbamothioyl)benzamide (CAS 58328-36-2) is a chemical compound with molecular formula C12H16N2OS and molecular weight 236.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(diethylcarbamothioyl)benzamide
Also Known As: N'-Benzoyl-N,N-diethylthiourea, N-(diethylcarbamothioyl)benzamide, 1-benzoyl-3,3-diethylthiourea, n,n-diethyl-n'-benzoylthiourea, 1,1-Diethyl-3-benzoylthiourea
| Molecular Formula | C12H16N2OS |
|---|---|
| Molecular Weight | 236.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.09833 |
| Heavy Atoms | 16 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 58328-36-2 |
|---|---|
| SMILES | CCN(CC)C(=S)NC(=O)C1=CC=CC=C1 |
| InChIKey | UQXSQVXCEQMCPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(diethylcarbamothioyl)benzamide (CAS 58328-36-2), with molecular formula C12H16N2OS and molecular weight 236.10 g/mol. IUPAC: N-(diethylcarbamothioyl)benzamide.
Chemical Property Profile of N-(diethylcarbamothioyl)benzamide
Property Insights of N-(diethylcarbamothioyl)benzamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(diethylcarbamothioyl)benzamide. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(diethylcarbamothioyl)benzamide. Following Lipinski's Rule of Five, N-(diethylcarbamothioyl)benzamide 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 N-(diethylcarbamothioyl)benzamide?
The CAS number of N-(diethylcarbamothioyl)benzamide is 58328-36-2.
What is the molecular formula of N-(diethylcarbamothioyl)benzamide?
The molecular formula of N-(diethylcarbamothioyl)benzamide is C12H16N2OS.
What is the molecular weight of N-(diethylcarbamothioyl)benzamide?
The molecular weight of N-(diethylcarbamothioyl)benzamide is 236.10 g/mol.
Where can I buy N-(diethylcarbamothioyl)benzamide?
You can request a quote for N-(diethylcarbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(diethylcarbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(diethylcarbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.