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N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide
TL;DR: N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide (CAS 651707-18-5) is a chemical compound with molecular formula C18H19BrN2OS and molecular weight 390.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide
Also Known As: N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide, AN-329/41166991, N-(2-bromophenyl)-N'-(4-tert-butylbenzoyl)thiourea, N-(2-Bromophenyl)-N/'-(4-tert-butylbenzoyl)thiourea, N-{[(2-bromophenyl)amino]carbonothioyl}-4-tert-butylbenzamide
| Molecular Formula | C18H19BrN2OS |
|---|---|
| Molecular Weight | 390.04 g/mol |
| LogP | 4.8734 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 390.04016 |
| Heavy Atoms | 23 |
| Complexity | 720.5466 |
Chemical Identifiers
| CAS Number | 651707-18-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2Br |
Product Overview
N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide (CAS 651707-18-5), with molecular formula C18H19BrN2OS and molecular weight 390.04 g/mol. IUPAC: N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide.
Chemical Property Profile of N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide
Property Insights of N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide
The XLogP value of 4.8734 indicates that N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide 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-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide 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-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide?
The CAS number of N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide is 651707-18-5.
What is the molecular formula of N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide?
The molecular formula of N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide is C18H19BrN2OS.
What is the molecular weight of N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide?
The molecular weight of N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide is 390.04 g/mol.
Where can I buy N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide?
You can request a quote for N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-bromophenyl)carbamothioyl]-4-tert-butylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.