N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide
TL;DR: N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide (CAS 139192-96-4) is a chemical compound with molecular formula C10H12BrN3S and molecular weight 284.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)pyrazolidine-1-carbothioamide
Also Known As: N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide, N-(4-bromophenyl)pyrazolidine-1-carbothioamide, 1-Pyrazolidinecarbothioamide, N-(4-bromophenyl)-, N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide #, RefChem:361777
| Molecular Formula | C10H12BrN3S |
|---|---|
| Molecular Weight | 284.99 g/mol |
| LogP | 2.3562 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 284.99353 |
| Heavy Atoms | 15 |
| Complexity | 346.19006 |
Chemical Identifiers
| CAS Number | 139192-96-4 |
|---|---|
| SMILES | C1CNN(C1)C(=S)NC2=CC=C(C=C2)Br |
Product Overview
N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide (CAS 139192-96-4), with molecular formula C10H12BrN3S and molecular weight 284.99 g/mol. IUPAC: N-(4-bromophenyl)pyrazolidine-1-carbothioamide.
Chemical Property Profile of N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide
Property Insights of N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide
The XLogP value of 2.3562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide. With a topological polar surface area (TPSA) of 27.3 Ų, N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide 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-(4-Bromophenyl)-1-pyrazolidinecarbothioamide?
The CAS number of N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide is 139192-96-4.
What is the molecular formula of N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide?
The molecular formula of N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide is C10H12BrN3S.
What is the molecular weight of N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide?
The molecular weight of N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide is 284.99 g/mol.
Where can I buy N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide?
You can request a quote for N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Bromophenyl)-1-pyrazolidinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.