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N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide
TL;DR: N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide (CAS 708289-54-7) is a chemical compound with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide
Also Known As: N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide, AN-329/42613581, N-(2-hydroxy-5-methylphenyl)-N'-isobutyrylthiourea, N-(2-Hydroxy-5-methylphenyl)-N/'-isobutyrylthiourea, N-{[(2-hydroxy-5-methylphenyl)amino]carbonothioyl}-2-methylpropanamide
| Molecular Formula | C12H16N2O2S |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 2.16962 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.09325 |
| Heavy Atoms | 17 |
| Complexity | 444.1318 |
Chemical Identifiers
| CAS Number | 708289-54-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)NC(=S)NC(=O)C(C)C |
Product Overview
N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide (CAS 708289-54-7), with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol. IUPAC: N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide.
Chemical Property Profile of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide
Property Insights of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide
The XLogP value of 2.16962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide. Following Lipinski's Rule of Five, N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide 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-5-methylphenyl)carbamothioyl]-2-methylpropanamide?
The CAS number of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide is 708289-54-7.
What is the molecular formula of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide?
The molecular formula of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide is C12H16N2O2S.
What is the molecular weight of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide?
The molecular weight of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide is 252.09 g/mol.
Where can I buy N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide?
You can request a quote for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide 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-5-methylphenyl)carbamothioyl]-2-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-2-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.