9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole
TL;DR: 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole (CAS 348118-45-6) is a chemical compound with molecular formula C16H12N4OS and molecular weight 308.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-carbazol-9-yl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone
Also Known As: BAS 00802082, BIM-0029085.P001, AB00094740-01, 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole, 9-[(4H-1,2,4-Triazol-3-ylsulfanyl)acetyl]-9H-carbazole
| Molecular Formula | C16H12N4OS |
|---|---|
| Molecular Weight | 308.07 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.07318 |
| Heavy Atoms | 22 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 348118-45-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3N2C(=O)CSC4=NC=NN4 |
| InChIKey | URPCANABNZNHRO-UHFFFAOYSA-N |
Product Overview
9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole (CAS 348118-45-6), with molecular formula C16H12N4OS and molecular weight 308.07 g/mol. IUPAC: 1-carbazol-9-yl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanone.
Chemical Property Profile of 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole
Property Insights of 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole
The XLogP value of 3.9 indicates that 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole. Following Lipinski's Rule of Five, 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole has 1 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 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole?
The CAS number of 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole is 348118-45-6.
What is the molecular formula of 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole?
The molecular formula of 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole is C16H12N4OS.
What is the molecular weight of 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole?
The molecular weight of 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole is 308.07 g/mol.
Where can I buy 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole?
You can request a quote for 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole?
Yes, KEHONG BIO provides custom synthesis services for 9-((1H-1,2,4-triazol-3-ylsulfanyl)acetyl)-9H-carbazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.