4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride
TL;DR: 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride (CAS 465513-98-8) is a chemical compound with molecular formula C9H5ClN2OS and molecular weight 223.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(thiadiazol-4-yl)benzoyl chloride
Also Known As: 4-(1,2,3-THIADIAZOL-4-YL)BENZOYL CHLORIDE, 4-(thiadiazol-4-yl)benzoyl chloride, 4- BENZOYLCHLORIDE, 4-(1,2,3-THIADIAZOL-4-YL)BENZOYLCHLORIDE, Benzoylchloride, 4-(1,2,3-thiadiazol-4-yl)-
| Molecular Formula | C9H5ClN2OS |
|---|---|
| Molecular Weight | 223.98 g/mol |
| LogP | 2.5841 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.98111 |
| Heavy Atoms | 14 |
| Complexity | 438.34534 |
Chemical Identifiers
| CAS Number | 465513-98-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CSN=N2)C(=O)Cl |
Product Overview
4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride (CAS 465513-98-8), with molecular formula C9H5ClN2OS and molecular weight 223.98 g/mol. IUPAC: 4-(thiadiazol-4-yl)benzoyl chloride.
Chemical Property Profile of 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride
Property Insights of 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride
The XLogP value of 2.5841 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride. With a topological polar surface area (TPSA) of 42.85 Ų, 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride has 0 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-(1,2,3-Thiadiazol-4-YL)benzoyl chloride?
The CAS number of 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride is 465513-98-8.
What is the molecular formula of 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride?
The molecular formula of 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride is C9H5ClN2OS.
What is the molecular weight of 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride?
The molecular weight of 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride is 223.98 g/mol.
Where can I buy 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride?
You can request a quote for 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,2,3-Thiadiazol-4-YL)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.