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N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide
TL;DR: N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide (CAS 429654-14-8) is a chemical compound with molecular formula C16H16N2O2S and molecular weight 300.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide
Also Known As: N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide, AB00112044-01, N-{[(2-hydroxy-4-methylphenyl)amino]thioxomethyl}(3-methylphenyl)carboxamide
| Molecular Formula | C16H16N2O2S |
|---|---|
| Molecular Weight | 300.09 g/mol |
| LogP | 3.13584 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.09326 |
| Heavy Atoms | 21 |
| Complexity | 698.4264 |
Chemical Identifiers
| CAS Number | 429654-14-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(=S)NC2=C(C=C(C=C2)C)O |
Product Overview
N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide (CAS 429654-14-8), with molecular formula C16H16N2O2S and molecular weight 300.09 g/mol. IUPAC: N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide.
Chemical Property Profile of N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide
Property Insights of N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide
The XLogP value of 3.13584 indicates that N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide 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-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide. Following Lipinski's Rule of Five, N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide 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-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide?
The CAS number of N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide is 429654-14-8.
What is the molecular formula of N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide?
The molecular formula of N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide is C16H16N2O2S.
What is the molecular weight of N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide?
The molecular weight of N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide is 300.09 g/mol.
Where can I buy N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide?
You can request a quote for N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.