5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide
TL;DR: 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide (CAS 729562-20-3) is a chemical compound with molecular formula C12H13BrClN3O2S and molecular weight 376.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide
Also Known As: 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide, 5-Bromo-2-chloro-N-[(morpholin-4-yl)carbamothioyl]benzamide
| Molecular Formula | C12H13BrClN3O2S |
|---|---|
| Molecular Weight | 376.96 g/mol |
| LogP | 1.954 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.96005 |
| Heavy Atoms | 20 |
| Complexity | 523.42395 |
Chemical Identifiers
| CAS Number | 729562-20-3 |
|---|---|
| SMILES | C1COCCN1NC(=S)NC(=O)C2=C(C=CC(=C2)Br)Cl |
Product Overview
5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide (CAS 729562-20-3), with molecular formula C12H13BrClN3O2S and molecular weight 376.96 g/mol. IUPAC: 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide.
Chemical Property Profile of 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide
Property Insights of 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide
The XLogP value of 1.954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide. With a topological polar surface area (TPSA) of 53.6 Ų, 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)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 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide?
The CAS number of 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide is 729562-20-3.
What is the molecular formula of 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide?
The molecular formula of 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide is C12H13BrClN3O2S.
What is the molecular weight of 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide?
The molecular weight of 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide is 376.96 g/mol.
Where can I buy 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide?
You can request a quote for 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 5-bromo-2-chloro-N-(morpholin-4-ylcarbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.