4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide
TL;DR: 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide (CAS 817632-62-5) is a chemical compound with molecular formula C15H22N2O2S and molecular weight 294.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide
Also Known As: 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide, 4-tert-butyl-N-{[(2-methoxyethyl)amino]carbonothioyl}benzamide, AN-329/42709795, N-(4-tert-butylbenzoyl)-N'-(2-methoxyethyl)thiourea, 4-tert-butyl-N-[(2-methoxyethyl)carbamothioyl]benzamide
| Molecular Formula | C15H22N2O2S |
|---|---|
| Molecular Weight | 294.14 g/mol |
| LogP | 2.2348 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.1402 |
| Heavy Atoms | 20 |
| Complexity | 463.75702 |
Chemical Identifiers
| CAS Number | 817632-62-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NCCOC |
Product Overview
4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide (CAS 817632-62-5), with molecular formula C15H22N2O2S and molecular weight 294.14 g/mol. IUPAC: 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide.
Chemical Property Profile of 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide
Property Insights of 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide
The XLogP value of 2.2348 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide. With a topological polar surface area (TPSA) of 50.36 Ų, 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide 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 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide?
The CAS number of 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide is 817632-62-5.
What is the molecular formula of 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide?
The molecular formula of 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide is C15H22N2O2S.
What is the molecular weight of 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide?
The molecular weight of 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide is 294.14 g/mol.
Where can I buy 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide?
You can request a quote for 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N-(2-methoxyethylcarbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.