N-(4-bromophenyl)pyrrolidine-1-carbothioamide
TL;DR: N-(4-bromophenyl)pyrrolidine-1-carbothioamide (CAS 356576-33-5) is a chemical compound with molecular formula C11H13BrN2S and molecular weight 284.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)pyrrolidine-1-carbothioamide
Also Known As: N-(4-bromophenyl)pyrrolidine-1-carbothioamide, N-(4-bromophenyl)-1-pyrrolidinecarbothioamide
| Molecular Formula | C11H13BrN2S |
|---|---|
| Molecular Weight | 284.00 g/mol |
| LogP | 3.2417 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 283.9983 |
| Heavy Atoms | 15 |
| Complexity | 344.11047 |
Chemical Identifiers
| CAS Number | 356576-33-5 |
|---|---|
| SMILES | C1CCN(C1)C(=S)NC2=CC=C(C=C2)Br |
Product Overview
N-(4-bromophenyl)pyrrolidine-1-carbothioamide (CAS 356576-33-5), with molecular formula C11H13BrN2S and molecular weight 284.00 g/mol. IUPAC: N-(4-bromophenyl)pyrrolidine-1-carbothioamide.
Chemical Property Profile of N-(4-bromophenyl)pyrrolidine-1-carbothioamide
Property Insights of N-(4-bromophenyl)pyrrolidine-1-carbothioamide
The XLogP value of 3.2417 indicates that N-(4-bromophenyl)pyrrolidine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.27 Ų, N-(4-bromophenyl)pyrrolidine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromophenyl)pyrrolidine-1-carbothioamide has 1 hydrogen bond donor(s) and 1 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)pyrrolidine-1-carbothioamide?
The CAS number of N-(4-bromophenyl)pyrrolidine-1-carbothioamide is 356576-33-5.
What is the molecular formula of N-(4-bromophenyl)pyrrolidine-1-carbothioamide?
The molecular formula of N-(4-bromophenyl)pyrrolidine-1-carbothioamide is C11H13BrN2S.
What is the molecular weight of N-(4-bromophenyl)pyrrolidine-1-carbothioamide?
The molecular weight of N-(4-bromophenyl)pyrrolidine-1-carbothioamide is 284.00 g/mol.
Where can I buy N-(4-bromophenyl)pyrrolidine-1-carbothioamide?
You can request a quote for N-(4-bromophenyl)pyrrolidine-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-(4-bromophenyl)pyrrolidine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromophenyl)pyrrolidine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.