![N-[(2-Phenylethyl)carbamothioyl]butanamide structure](/static/products/6986/6986-93-2.webp)
N-[(2-Phenylethyl)carbamothioyl]butanamide
TL;DR: N-[(2-Phenylethyl)carbamothioyl]butanamide (CAS 6986-93-2) is a chemical compound with molecular formula C13H18N2OS and molecular weight 250.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-phenylethylcarbamothioyl)butanamide
Also Known As: N-(phenethylcarbamothioyl)butanamide, N-(phenethylthiocarbamoyl)butanamide, N-(2-phenylethylcarbamothioyl)butanamide, N-[(2-Phenylethyl)carbamothioyl]butanamide
| Molecular Formula | C13H18N2OS |
|---|---|
| Molecular Weight | 250.11 g/mol |
| LogP | 2.0199 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.11398 |
| Heavy Atoms | 17 |
| Complexity | 364.94202 |
Chemical Identifiers
| CAS Number | 6986-93-2 |
|---|---|
| SMILES | CCCC(=O)NC(=S)NCCC1=CC=CC=C1 |
Product Overview
N-[(2-Phenylethyl)carbamothioyl]butanamide (CAS 6986-93-2), with molecular formula C13H18N2OS and molecular weight 250.11 g/mol. IUPAC: N-(2-phenylethylcarbamothioyl)butanamide.
Chemical Property Profile of N-[(2-Phenylethyl)carbamothioyl]butanamide
Property Insights of N-[(2-Phenylethyl)carbamothioyl]butanamide
The XLogP value of 2.0199 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-Phenylethyl)carbamothioyl]butanamide. With a topological polar surface area (TPSA) of 41.13 Ų, N-[(2-Phenylethyl)carbamothioyl]butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2-Phenylethyl)carbamothioyl]butanamide has 2 hydrogen bond donor(s) and 2 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-Phenylethyl)carbamothioyl]butanamide?
The CAS number of N-[(2-Phenylethyl)carbamothioyl]butanamide is 6986-93-2.
What is the molecular formula of N-[(2-Phenylethyl)carbamothioyl]butanamide?
The molecular formula of N-[(2-Phenylethyl)carbamothioyl]butanamide is C13H18N2OS.
What is the molecular weight of N-[(2-Phenylethyl)carbamothioyl]butanamide?
The molecular weight of N-[(2-Phenylethyl)carbamothioyl]butanamide is 250.11 g/mol.
Where can I buy N-[(2-Phenylethyl)carbamothioyl]butanamide?
You can request a quote for N-[(2-Phenylethyl)carbamothioyl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-Phenylethyl)carbamothioyl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-Phenylethyl)carbamothioyl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.