![N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide structure](/static/products/6234/62345-59-9.webp)
N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide
TL;DR: N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide (CAS 62345-59-9) is a chemical compound with molecular formula C20H25N5S2 and molecular weight 399.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide
Also Known As: BAS 01269121, N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide, N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-c, N-phenyl-4-{2-[(phenylcarbamothioyl)amino]ethyl}piperazine-1-carbothioamide, 4-[2-(3-Phenyl-thioureido)-ethyl]-piperazine-1-carbothioic acid phenylamide
| Molecular Formula | C20H25N5S2 |
|---|---|
| Molecular Weight | 399.16 g/mol |
| LogP | 2.9876 |
| Topological Polar Surface Area | 42.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.15515 |
| Heavy Atoms | 27 |
| Complexity | 727.7971 |
Chemical Identifiers
| CAS Number | 62345-59-9 |
|---|---|
| SMILES | C1CN(CCN1CCNC(=S)NC2=CC=CC=C2)C(=S)NC3=CC=CC=C3 |
Product Overview
N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide (CAS 62345-59-9), with molecular formula C20H25N5S2 and molecular weight 399.16 g/mol. IUPAC: N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide.
Chemical Property Profile of N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide
Property Insights of N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide
The XLogP value of 2.9876 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide. With a topological polar surface area (TPSA) of 42.57 Ų, N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide 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-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide?
The CAS number of N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide is 62345-59-9.
What is the molecular formula of N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide?
The molecular formula of N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide is C20H25N5S2.
What is the molecular weight of N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide?
The molecular weight of N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide is 399.16 g/mol.
Where can I buy N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide?
You can request a quote for N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-phenyl-4-[2-(phenylcarbamothioylamino)ethyl]piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.