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N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide
TL;DR: N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide (CAS 429652-95-9) is a chemical compound with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide
Also Known As: N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide
| Molecular Formula | C18H20N2O2S |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 3.8165 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.12454 |
| Heavy Atoms | 23 |
| Complexity | 721.5466 |
Chemical Identifiers
| CAS Number | 429652-95-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=CC=C2 |
Product Overview
N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide (CAS 429652-95-9), with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol. IUPAC: N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide.
Chemical Property Profile of N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide
Property Insights of N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide
The XLogP value of 3.8165 indicates that N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide. Following Lipinski's Rule of Five, N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide has 3 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 N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide?
The CAS number of N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide is 429652-95-9.
What is the molecular formula of N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide?
The molecular formula of N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide is C18H20N2O2S.
What is the molecular weight of N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide?
The molecular weight of N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide is 328.12 g/mol.
Where can I buy N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide?
You can request a quote for N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-tert-butyl-2-hydroxyphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.