1,2,3-Thiadiazole-4-carbaldehyde
TL;DR: 1,2,3-Thiadiazole-4-carbaldehyde (CAS 27643-15-8) is a chemical compound with molecular formula C3H2N2OS and molecular weight 113.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thiadiazole-4-carbaldehyde
Also Known As: 1,2,3-thiadiazole-4-carbaldehyde, 1,2,3-Thiadiazole-4-carboxaldehyde, thiadiazole-4-carbaldehyde, 4-thiadiazolecarboxaldehyde, 123-Thiadiazole-4-carboxaldehyde
| Molecular Formula | C3H2N2OS |
|---|---|
| Molecular Weight | 113.99 g/mol |
| LogP | 0.3506 |
| Topological Polar Surface Area | 42.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 113.988785 |
| Heavy Atoms | 7 |
| Complexity | 147.97833 |
Chemical Identifiers
| CAS Number | 27643-15-8 |
|---|---|
| SMILES | C1=C(N=NS1)C=O |
Product Overview
1,2,3-Thiadiazole-4-carbaldehyde (CAS 27643-15-8), with molecular formula C3H2N2OS and molecular weight 113.99 g/mol. IUPAC: thiadiazole-4-carbaldehyde.
Chemical Property Profile of 1,2,3-Thiadiazole-4-carbaldehyde
Property Insights of 1,2,3-Thiadiazole-4-carbaldehyde
The XLogP value of 0.3506 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3-Thiadiazole-4-carbaldehyde. With a topological polar surface area (TPSA) of 42.85 Ų, 1,2,3-Thiadiazole-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3-Thiadiazole-4-carbaldehyde 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 1,2,3-Thiadiazole-4-carbaldehyde?
The CAS number of 1,2,3-Thiadiazole-4-carbaldehyde is 27643-15-8.
What is the molecular formula of 1,2,3-Thiadiazole-4-carbaldehyde?
The molecular formula of 1,2,3-Thiadiazole-4-carbaldehyde is C3H2N2OS.
What is the molecular weight of 1,2,3-Thiadiazole-4-carbaldehyde?
The molecular weight of 1,2,3-Thiadiazole-4-carbaldehyde is 113.99 g/mol.
Where can I buy 1,2,3-Thiadiazole-4-carbaldehyde?
You can request a quote for 1,2,3-Thiadiazole-4-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3-Thiadiazole-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3-Thiadiazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.