4-Bromo-N-(morpholine-4-carbonothioyl)benzamide
TL;DR: 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide (CAS 160627-57-6) is a chemical compound with molecular formula C12H13BrN2O2S and molecular weight 327.9881 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-N-(morpholine-4-carbothioyl)benzamide
Also Known As: 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide, 4-bromo-N-(morpholine-4-carbothioyl)benzamide, BIM-0025167.P001, 4-[N-(4-bromobenzoyl)(thiocarbamoyl)]morpholine, 4-Bromo-N-(morpholin-4-yl-carbothioyl)benzamide
Technical Specifications
| Molecular Formula | C12H13BrN2O2S |
| Molecular Weight | 327.9881 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 73.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 327.9881 Da |
| Heavy Atoms | 18 |
| Complexity | 313.0 |
| SMILES | C1COCCN1C(=S)NC(=O)C2=CC=C(C=C2)Br |
| InChIKey | YRAIXCRIIRBOMD-UHFFFAOYSA-N |
Chemical Property Profile of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide
Property Insights of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide. Following Lipinski's Rule of Five, 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide?
The CAS number of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide is 160627-57-6.
What is the molecular formula of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide?
The molecular formula of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide is C12H13BrN2O2S.
What is the molecular weight of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide?
The molecular weight of 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide is 327.9881 g/mol.
Where can I buy 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide?
You can request a quote for 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide?
Yes, CoreyChem provides custom synthesis services for 4-Bromo-N-(morpholine-4-carbonothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.