![N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide structure](/static/products/791/791789-37-2.png)
N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide
TL;DR: N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide (CAS 791789-37-2) is a chemical compound with molecular formula C13H18N2O2S and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide
Also Known As: AN-329/41162774, N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide, N-(2-hydroxy-5-methylphenyl)-N'-(3-methylbutanoyl)thiourea, N-{[(2-hydroxy-5-methylphenyl)amino]carbonothioyl}-3-methylbutanamide, N-{[(2-hydroxy-5-methylphenyl)amino]thioxomethyl}-3-methylbutanamide
| Molecular Formula | C13H18N2O2S |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 2.55972 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 266.1089 |
| Heavy Atoms | 18 |
| Complexity | 458.3045 |
Chemical Identifiers
| CAS Number | 791789-37-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)O)NC(=S)NC(=O)CC(C)C |
Product Overview
N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide (CAS 791789-37-2), with molecular formula C13H18N2O2S and molecular weight 266.11 g/mol. IUPAC: N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide.
Chemical Property Profile of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide
Property Insights of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide
The XLogP value of 2.55972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide. Following Lipinski's Rule of Five, N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide 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]-3-methylbutanamide?
The CAS number of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide is 791789-37-2.
What is the molecular formula of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide?
The molecular formula of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide is C13H18N2O2S.
What is the molecular weight of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide?
The molecular weight of N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide is 266.11 g/mol.
Where can I buy N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide?
You can request a quote for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide 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]-3-methylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-hydroxy-5-methylphenyl)carbamothioyl]-3-methylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.