Hydrochlorothiazide hydrochloride
TL;DR: Hydrochlorothiazide hydrochloride (CAS 42461-28-9) is a chemical compound with molecular formula C7H9Cl2N3O4S2 and molecular weight 332.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide;hydrochloride
Also Known As: Hydrochlorothiazide HCl, Hydrochlorothiazide hydrochloride, 6-chloro-1,1-dioxo-3,4-dihydro-2H-1, 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3,4-dihydro-, 1,1-dioxide, hydrochloride, 6-Chloro-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide, hydrochloride
| Molecular Formula | C7H9Cl2N3O4S2 |
|---|---|
| Molecular Weight | 332.94 g/mol |
| LogP | 0.0705 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.94116 |
| Heavy Atoms | 18 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 42461-28-9 |
|---|---|
| SMILES | C1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl.Cl |
| InChIKey | HNLAFWZKHCUIMC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hydrochlorothiazide hydrochloride (CAS 42461-28-9), with molecular formula C7H9Cl2N3O4S2 and molecular weight 332.94 g/mol. IUPAC: 6-chloro-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide;hydrochloride.
Chemical Property Profile of Hydrochlorothiazide hydrochloride
Property Insights of Hydrochlorothiazide hydrochloride
The XLogP value of 0.0705 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrochlorothiazide hydrochloride. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydrochlorothiazide hydrochloride. Following Lipinski's Rule of Five, Hydrochlorothiazide hydrochloride has 4 hydrogen bond donor(s) and 7 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 Hydrochlorothiazide hydrochloride?
The CAS number of Hydrochlorothiazide hydrochloride is 42461-28-9.
What is the molecular formula of Hydrochlorothiazide hydrochloride?
The molecular formula of Hydrochlorothiazide hydrochloride is C7H9Cl2N3O4S2.
What is the molecular weight of Hydrochlorothiazide hydrochloride?
The molecular weight of Hydrochlorothiazide hydrochloride is 332.94 g/mol.
Where can I buy Hydrochlorothiazide hydrochloride?
You can request a quote for Hydrochlorothiazide hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrochlorothiazide hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Hydrochlorothiazide hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.