![4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide structure](/static/products/499/499975-45-0.png)
4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide
TL;DR: 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide (CAS 499975-45-0) is a chemical compound with molecular formula C15H20BrN3O2S and molecular weight 385.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-(3-morpholin-4-ylpropylcarbamothioyl)benzamide
Also Known As: BAS 00435568, 4-bromo-N-((3-morpholinopropyl)carbamothioyl)benzamide, 4-bromo-N-(3-morpholin-4-ylpropylcarbamothioyl)benzamide, 1-(4-Bromo-benzoyl)-3-(3-morpholin-4-yl-propyl)-thiourea, 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide
| Molecular Formula | C15H20BrN3O2S |
|---|---|
| Molecular Weight | 385.05 g/mol |
| LogP | 1.7757 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.04596 |
| Heavy Atoms | 22 |
| Complexity | 504.01395 |
Chemical Identifiers
| CAS Number | 499975-45-0 |
|---|---|
| SMILES | C1COCCN1CCCNC(=S)NC(=O)C2=CC=C(C=C2)Br |
Product Overview
4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide (CAS 499975-45-0), with molecular formula C15H20BrN3O2S and molecular weight 385.05 g/mol. IUPAC: 4-bromo-N-(3-morpholin-4-ylpropylcarbamothioyl)benzamide.
Chemical Property Profile of 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide
Property Insights of 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide
The XLogP value of 1.7757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide. With a topological polar surface area (TPSA) of 53.6 Ų, 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-{[3-(morpholin-4-yl)propyl]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 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide?
The CAS number of 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide is 499975-45-0.
What is the molecular formula of 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide?
The molecular formula of 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide is C15H20BrN3O2S.
What is the molecular weight of 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide?
The molecular weight of 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide is 385.05 g/mol.
Where can I buy 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide?
You can request a quote for 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-{[3-(morpholin-4-yl)propyl]carbamothioyl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.