![3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide structure](/static/products/4256/425665-07-2.webp)
3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
TL;DR: 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide (CAS 425665-07-2) is a chemical compound with molecular formula C18H18BrN3O2S and molecular weight 419.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
Also Known As: AB00107153-01, 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide, 3-bromo-N-{[4-(morpholin-4-yl)phenyl]carbamothioyl}benzamide, 3-(3-BROMOBENZOYL)-1-[4-(MORPHOLIN-4-YL)PHENYL]THIOUREA, (3-bromophenyl)-N-{[(4-morpholin-4-ylphenyl)amino]thioxomethyl}carboxamide
| Molecular Formula | C18H18BrN3O2S |
|---|---|
| Molecular Weight | 419.03 g/mol |
| LogP | 3.4125 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.0303 |
| Heavy Atoms | 25 |
| Complexity | 761.17145 |
Chemical Identifiers
| CAS Number | 425665-07-2 |
|---|---|
| SMILES | C1COCCN1C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC=C3)Br |
Product Overview
3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide (CAS 425665-07-2), with molecular formula C18H18BrN3O2S and molecular weight 419.03 g/mol. IUPAC: 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide.
Chemical Property Profile of 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
Property Insights of 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide
The XLogP value of 3.4125 indicates that 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.6 Ų, 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide has 2 hydrogen bond donor(s) and 4 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 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
The CAS number of 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is 425665-07-2.
What is the molecular formula of 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
The molecular formula of 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is C18H18BrN3O2S.
What is the molecular weight of 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
The molecular weight of 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide is 419.03 g/mol.
Where can I buy 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
You can request a quote for 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-bromo-N-[(4-morpholin-4-ylphenyl)carbamothioyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.