![N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide structure](/static/products/4454/445419-13-6.webp)
N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide
TL;DR: N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide (CAS 445419-13-6) is a chemical compound with molecular formula C14H10BrFN2OS and molecular weight 351.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide
Also Known As: N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide, N-(3-bromophenyl)-N'-(4-fluorobenzoyl)thiourea, AN-465/41166310
| Molecular Formula | C14H10BrFN2OS |
|---|---|
| Molecular Weight | 351.97 g/mol |
| LogP | 3.715 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.9681 |
| Heavy Atoms | 20 |
| Complexity | 645.8771 |
Chemical Identifiers
| CAS Number | 445419-13-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)NC(=S)NC(=O)C2=CC=C(C=C2)F |
Product Overview
N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide (CAS 445419-13-6), with molecular formula C14H10BrFN2OS and molecular weight 351.97 g/mol. IUPAC: N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide.
Chemical Property Profile of N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide
Property Insights of N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide
The XLogP value of 3.715 indicates that N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide 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-bromophenyl)carbamothioyl]-4-fluorobenzamide?
The CAS number of N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide is 445419-13-6.
What is the molecular formula of N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide?
The molecular formula of N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide is C14H10BrFN2OS.
What is the molecular weight of N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide?
The molecular weight of N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide is 351.97 g/mol.
Where can I buy N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide?
You can request a quote for N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-bromophenyl)carbamothioyl]-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.