3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde
TL;DR: 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde (CAS 876665-06-4) is a chemical compound with molecular formula C13H9N3OS and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-1-(1,3-thiazol-2-yl)pyrazole-4-carbaldehyde
Also Known As: 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde, 3-phenyl-1-(1,3-thiazol-2-yl)pyrazole-4-carbaldehyde, AP-144/15503002
| Molecular Formula | C13H9N3OS |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 2.8083 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 255.04663 |
| Heavy Atoms | 18 |
| Complexity | 658.8734 |
Chemical Identifiers
| CAS Number | 876665-06-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN(C=C2C=O)C3=NC=CS3 |
Product Overview
3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde (CAS 876665-06-4), with molecular formula C13H9N3OS and molecular weight 255.05 g/mol. IUPAC: 3-phenyl-1-(1,3-thiazol-2-yl)pyrazole-4-carbaldehyde.
Chemical Property Profile of 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde
Property Insights of 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde
The XLogP value of 2.8083 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde. With a topological polar surface area (TPSA) of 47.78 Ų, 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-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 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde?
The CAS number of 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde is 876665-06-4.
What is the molecular formula of 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde?
The molecular formula of 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde is C13H9N3OS.
What is the molecular weight of 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde?
The molecular weight of 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde is 255.05 g/mol.
Where can I buy 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde?
You can request a quote for 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-phenyl-1-(1,3-thiazol-2-yl)-1H-pyrazole-4-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.