3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol
TL;DR: 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol (CAS 59552-82-8) is a chemical compound with molecular formula C18H17N3OS and molecular weight 323.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-phenyl-10-thia-8,13,16-triazatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,8-tetraen-12-ol
Also Known As: phenyl[?]ol, NCI60_002325, 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol, 2H-5-Thia-2a,6,10c-triazaaceanthrylen-3-ol der.
| Molecular Formula | C18H17N3OS |
|---|---|
| Molecular Weight | 323.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.10922 |
| Heavy Atoms | 23 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 59552-82-8 |
|---|---|
| SMILES | C1CN2C(CSC3=NC4=CC=CC=C4C1N32)(C5=CC=CC=C5)O |
| InChIKey | ZNWIULDAACUKJA-UHFFFAOYSA-N |
Product Overview
3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol (CAS 59552-82-8), with molecular formula C18H17N3OS and molecular weight 323.11 g/mol. IUPAC: 12-phenyl-10-thia-8,13,16-triazatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,8-tetraen-12-ol.
Chemical Property Profile of 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol
Property Insights of 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol. Following Lipinski's Rule of Five, 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol 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 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol?
The CAS number of 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol is 59552-82-8.
What is the molecular formula of 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol?
The molecular formula of 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol is C18H17N3OS.
What is the molecular weight of 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol?
The molecular weight of 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol is 323.11 g/mol.
Where can I buy 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol?
You can request a quote for 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-1,3,4,10b-tetrahydro-2H-5-thia-2a,6,10c-triazaaceanthrylen-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.