泊氟噻嗪
TL;DR: 泊氟噻嗪 (CAS 1766-91-2) is a chemical compound with molecular formula C13H18F3N3O4S2 and molecular weight 401.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
泊氟噻嗪
1,1-dioxo-3-pentyl-6-(trifluoromethyl)-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
Also Known As: penflutizide, Penflutizida, Penfluzide, Penflutizidum, Pentylhydroflumethiazide
| Molecular Formula | C13H18F3N3O4S2 |
|---|---|
| Molecular Weight | 401.07 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.0691 |
| Heavy Atoms | 25 |
| Complexity | 670.0 |
Chemical Identifiers
| CAS Number | 1766-91-2 |
|---|---|
| SMILES | CCCCCC1NC2=C(C=C(C(=C2)C(F)(F)F)S(=O)(=O)N)S(=O)(=O)N1 |
| InChIKey | AKHXXQAIVSMYIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
泊氟噻嗪 (CAS 1766-91-2), with molecular formula C13H18F3N3O4S2 and molecular weight 401.07 g/mol. IUPAC: 1,1-dioxo-3-pentyl-6-(trifluoromethyl)-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide.
Chemical Property Profile of 泊氟噻嗪
Property Insights of 泊氟噻嗪
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 泊氟噻嗪. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 泊氟噻嗪. Following Lipinski's Rule of Five, Penflutizide has 3 hydrogen bond donor(s) and 10 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 Penflutizide?
The CAS number of Penflutizide is 1766-91-2.
What is the molecular formula of Penflutizide?
The molecular formula of Penflutizide is C13H18F3N3O4S2.
What is the molecular weight of Penflutizide?
The molecular weight of Penflutizide is 401.07 g/mol.
Where can I buy Penflutizide?
You can request a quote for Penflutizide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Penflutizide?
Yes, KEHONG BIO provides custom synthesis services for Penflutizide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.