7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione
TL;DR: 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione (CAS 102202-53-9) is a chemical compound with molecular formula C16H11N3O3S and molecular weight 325.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-methoxy-3-phenyl-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,4-dione
Also Known As: 7-METHOXY-3-PHENYL-9-THIA-1,3,4A-TRIAZA-FLUORENE-2,4-DIONE, 8-methoxy-3-phenyl-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,4-dione, Benzene,1-chloro-4-(1,1-dichloro-2,2,2-trifluoroethoxy), 8-methoxy-3-phenyl-2H-benzo[4,5]thiazolo[3,2-a][1,3,5]triazine-2,4(3H)-dione, 8-methoxy-3-phenyl-2H-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,4(3H)-dione
| Molecular Formula | C16H11N3O3S |
|---|---|
| Molecular Weight | 325.05 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.05212 |
| Heavy Atoms | 23 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 102202-53-9 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)N3C(=NC(=O)N(C3=O)C4=CC=CC=C4)S2 |
| InChIKey | KUGKZOHZBILEGZ-UHFFFAOYSA-N |
Product Overview
7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione (CAS 102202-53-9), with molecular formula C16H11N3O3S and molecular weight 325.05 g/mol. IUPAC: 8-methoxy-3-phenyl-[1,3,5]triazino[2,1-b][1,3]benzothiazole-2,4-dione.
Chemical Property Profile of 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione
Property Insights of 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione
The XLogP value of 3.1 indicates that 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione. Following Lipinski's Rule of Five, 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione 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 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione?
The CAS number of 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione is 102202-53-9.
What is the molecular formula of 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione?
The molecular formula of 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione is C16H11N3O3S.
What is the molecular weight of 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione?
The molecular weight of 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione is 325.05 g/mol.
Where can I buy 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione?
You can request a quote for 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Methoxy-3-phenyl-9-thia-1,3,4A-triaza-fluorene-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.