4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde
TL;DR: 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde (CAS 883291-36-9) is a chemical compound with molecular formula C8H7N3OS and molecular weight 193.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,2,4-triazol-1-ylmethyl)thiophene-2-carbaldehyde
Also Known As: ZERO/005473, 4-(1,2,4-triazol-1-ylmethyl)thiophene-2-carbaldehyde, 4-(1H-1,2,4-triazol-1-ylmethyl)thiophene-2-carbaldehyde, 4-((1H-1,2,4-triazol-1-yl)methyl)thiophene-2-carbaldehyde, 4-(1,2,4-triazolylmethyl)thiophene-2-carbaldehyde
| Molecular Formula | C8H7N3OS |
|---|---|
| Molecular Weight | 193.03 g/mol |
| LogP | 1.2004 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.03099 |
| Heavy Atoms | 13 |
| Complexity | 393.19696 |
Chemical Identifiers
| CAS Number | 883291-36-9 |
|---|---|
| SMILES | C1=C(SC=C1CN2C=NC=N2)C=O |
Product Overview
4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde (CAS 883291-36-9), with molecular formula C8H7N3OS and molecular weight 193.03 g/mol. IUPAC: 4-(1,2,4-triazol-1-ylmethyl)thiophene-2-carbaldehyde.
Chemical Property Profile of 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde
Property Insights of 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde
The XLogP value of 1.2004 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde. With a topological polar surface area (TPSA) of 47.78 Ų, 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-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 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde?
The CAS number of 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde is 883291-36-9.
What is the molecular formula of 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde?
The molecular formula of 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde is C8H7N3OS.
What is the molecular weight of 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde?
The molecular weight of 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde is 193.03 g/mol.
Where can I buy 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde?
You can request a quote for 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,2,4-Triazol-1-ylmethyl)thiophene-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.