![N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide structure](/static/products/4296/429654-85-3.webp)
N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide
TL;DR: N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide (CAS 429654-85-3) is a chemical compound with molecular formula C11H13ClN2OS and molecular weight 256.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide
Also Known As: N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide, N-(3-chloro-4-methylphenyl)-N'-propionylthiourea, N-(3-Chloro-4-methylphenyl)-N/'-propionylthiourea, N-{[(3-chloro-4-methylphenyl)amino]carbonothioyl}propanamide
| Molecular Formula | C11H13ClN2OS |
|---|---|
| Molecular Weight | 256.04 g/mol |
| LogP | 2.87142 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.0437 |
| Heavy Atoms | 16 |
| Complexity | 420.44562 |
Chemical Identifiers
| CAS Number | 429654-85-3 |
|---|---|
| SMILES | CCC(=O)NC(=S)NC1=CC(=C(C=C1)C)Cl |
Product Overview
N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide (CAS 429654-85-3), with molecular formula C11H13ClN2OS and molecular weight 256.04 g/mol. IUPAC: N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide.
Chemical Property Profile of N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide
Property Insights of N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide
The XLogP value of 2.87142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide. With a topological polar surface area (TPSA) of 41.13 Ų, N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide 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-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide?
The CAS number of N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide is 429654-85-3.
What is the molecular formula of N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide?
The molecular formula of N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide is C11H13ClN2OS.
What is the molecular weight of N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide?
The molecular weight of N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide is 256.04 g/mol.
Where can I buy N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide?
You can request a quote for N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-chloro-4-methylphenyl)carbamothioyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.