5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮
TL;DR: 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 (CAS 16383-97-4) is a chemical compound with molecular formula C19H9N3OS and molecular weight 327.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮
8-thia-14,15,17-triazahexacyclo[10.9.2.02,7.09,22.014,18.019,23]tricosa-1(22),2,4,6,9,11,15,17,19(23),20-decaen-13-one
Also Known As: 5H-Thioxantheno[2,1,9-def][1,2,4]triazolo[5,1-a]isoquinolin-5-one, 5H-Thioxantheno(2,1,9-def)(1,2,4)triazolo(5,1-a)isoquinolin-5-one, 5H-Thioxantheno(2,1,9-def)-s-triazolo(1,5-a)isoquinolin-5-one, 5H-Benzo[3,4]isothiochromeno[7,8,1-def][1,2,4]triazolo[1,5-b, 5H-Thioxantheno[2,1,9-def]-s-triazolo[5,1-a]isoquinolin-5-one
| Molecular Formula | C19H9N3OS |
|---|---|
| Molecular Weight | 327.05 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 327.04663 |
| Heavy Atoms | 24 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 16383-97-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C(=CC=C5C4=C(C=C3)C6=NC=NN6C5=O)S2 |
| InChIKey | CAIKUTQDZQNKFP-UHFFFAOYSA-N |
Product Overview
5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 (CAS 16383-97-4), with molecular formula C19H9N3OS and molecular weight 327.05 g/mol. IUPAC: 8-thia-14,15,17-triazahexacyclo[10.9.2.02,7.09,22.014,18.019,23]tricosa-1(22),2,4,6,9,11,15,17,19(23),20-decaen-13-one.
Chemical Property Profile of 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮
Property Insights of 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮
The XLogP value of 4.3 indicates that 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮. Following Lipinski's Rule of Five, 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 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 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮?
The CAS number of 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 is 16383-97-4.
What is the molecular formula of 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮?
The molecular formula of 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 is C19H9N3OS.
What is the molecular weight of 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮?
The molecular weight of 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 is 327.05 g/mol.
Where can I buy 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮?
You can request a quote for 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮?
Yes, KEHONG BIO provides custom synthesis services for 5H-硫杂蒽并(2,1,9-def)(1,2,4)三唑并(5,1-a)异喹啉-5-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.