![3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide structure](/static/products/6429/642951-14-2.webp)
3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide
TL;DR: 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide (CAS 642951-14-2) is a chemical compound with molecular formula C16H13Cl3N2OS and molecular weight 385.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide
Also Known As: 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide, 3-phenyl-N-{[(2,4,5-trichlorophenyl)amino]carbonothioyl}propanamide
| Molecular Formula | C16H13Cl3N2OS |
|---|---|
| Molecular Weight | 385.98 g/mol |
| LogP | 5.0926 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 385.9814 |
| Heavy Atoms | 23 |
| Complexity | 722.7653 |
Chemical Identifiers
| CAS Number | 642951-14-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl |
Product Overview
3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide (CAS 642951-14-2), with molecular formula C16H13Cl3N2OS and molecular weight 385.98 g/mol. IUPAC: 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide.
Chemical Property Profile of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide
Property Insights of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide
The XLogP value of 5.0926 indicates that 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide?
The CAS number of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide is 642951-14-2.
What is the molecular formula of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide?
The molecular formula of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide is C16H13Cl3N2OS.
What is the molecular weight of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide?
The molecular weight of 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide is 385.98 g/mol.
Where can I buy 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide?
You can request a quote for 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-phenyl-N-[(2,4,5-trichlorophenyl)carbamothioyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.