![4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide structure](/static/products/501/501106-35-0.png)
4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide
TL;DR: 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide (CAS 501106-35-0) is a chemical compound with molecular formula C20H23N3O2S and molecular weight 369.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide
Also Known As: AB01321582-02, AN-329/41560348, 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide, 4-tert-butyl-N-{[2-(3-methylbenzoyl)hydrazino]carbonothioyl}benzamide, 4-tert-butyl-N-{[2-(3-methylbenzoyl)hydrazino]carbothioyl}benzamide
| Molecular Formula | C20H23N3O2S |
|---|---|
| Molecular Weight | 369.15 g/mol |
| LogP | 3.24182 |
| Topological Polar Surface Area | 70.23 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 369.1511 |
| Heavy Atoms | 26 |
| Complexity | 823.69507 |
Chemical Identifiers
| CAS Number | 501106-35-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)C(C)(C)C |
Product Overview
4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide (CAS 501106-35-0), with molecular formula C20H23N3O2S and molecular weight 369.15 g/mol. IUPAC: 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide.
Chemical Property Profile of 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide
Property Insights of 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide
The XLogP value of 3.24182 indicates that 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide. Following Lipinski's Rule of Five, 4-tert-butyl-N-[[(3-methylbenzoyl)amino]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 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide?
The CAS number of 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide is 501106-35-0.
What is the molecular formula of 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide?
The molecular formula of 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide is C20H23N3O2S.
What is the molecular weight of 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide?
The molecular weight of 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide is 369.15 g/mol.
Where can I buy 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide?
You can request a quote for 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]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-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N-[[(3-methylbenzoyl)amino]carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.