2-(3-Bromobenzoyl)hydrazinecarbothioamide
TL;DR: 2-(3-Bromobenzoyl)hydrazinecarbothioamide (CAS 126651-84-1) is a chemical compound with molecular formula C8H8BrN3OS and molecular weight 272.95715 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3-bromobenzoyl)amino]thiourea
Also Known As: [(3-bromobenzoyl)amino]thiourea|2-(3-bromobenzoyl)hydrazinecarbothioamide|(m-bromophenyl)thiosemicarbazidomethanone|F0227-0105|SR-01000005233-1|N-[(aminothioxomethyl)amino](3-bromophenyl)carboxamide|MLS000420219|CHEMBL1399692|SMSSF-0040158|SMR000322826|ST50112861|SR-01000005233
Technical Specifications
| Molecular Formula | C8H8BrN3OS |
| Molecular Weight | 272.95715 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 99.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.95715 Da |
| Heavy Atoms | 14 |
| Complexity | 237.0 |
| SMILES | C1=CC(=CC(=C1)Br)C(=O)NNC(=S)N |
| InChIKey | RGXFOKHIGCHXKR-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Bromobenzoyl)hydrazinecarbothioamide
Property Insights of 2-(3-Bromobenzoyl)hydrazinecarbothioamide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Bromobenzoyl)hydrazinecarbothioamide. The TPSA of 99.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Bromobenzoyl)hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-(3-Bromobenzoyl)hydrazinecarbothioamide has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3-Bromobenzoyl)hydrazinecarbothioamide?
The CAS number of 2-(3-Bromobenzoyl)hydrazinecarbothioamide is 126651-84-1.
What is the molecular formula of 2-(3-Bromobenzoyl)hydrazinecarbothioamide?
The molecular formula of 2-(3-Bromobenzoyl)hydrazinecarbothioamide is C8H8BrN3OS.
What is the molecular weight of 2-(3-Bromobenzoyl)hydrazinecarbothioamide?
The molecular weight of 2-(3-Bromobenzoyl)hydrazinecarbothioamide is 272.95715 g/mol.
Where can I buy 2-(3-Bromobenzoyl)hydrazinecarbothioamide?
You can request a quote for 2-(3-Bromobenzoyl)hydrazinecarbothioamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Bromobenzoyl)hydrazinecarbothioamide?
Yes, CoreyChem provides custom synthesis services for 2-(3-Bromobenzoyl)hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.