Benzylhydrochlorothiazide
TL;DR: Benzylhydrochlorothiazide (CAS 1824-50-6) is a chemical compound with molecular formula C14H14ClN3O4S2 and molecular weight 387.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-6-chloro-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
Also Known As: benzylhydrochlorothiazide, Behyd, Benclortriazide, Benzclortriazide, Benzylhydrochlorthiazide
| Molecular Formula | C14H14ClN3O4S2 |
|---|---|
| Molecular Weight | 387.01 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 387.0114 |
| Heavy Atoms | 24 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 1824-50-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2NC3=CC(=C(C=C3S(=O)(=O)N2)S(=O)(=O)N)Cl |
| InChIKey | BWSSMIJUDVUASQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzylhydrochlorothiazide (CAS 1824-50-6), with molecular formula C14H14ClN3O4S2 and molecular weight 387.01 g/mol. IUPAC: 3-benzyl-6-chloro-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide.
Chemical Property Profile of Benzylhydrochlorothiazide
Property Insights of Benzylhydrochlorothiazide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzylhydrochlorothiazide. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzylhydrochlorothiazide. Following Lipinski's Rule of Five, Benzylhydrochlorothiazide has 3 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 Benzylhydrochlorothiazide?
The CAS number of Benzylhydrochlorothiazide is 1824-50-6.
What is the molecular formula of Benzylhydrochlorothiazide?
The molecular formula of Benzylhydrochlorothiazide is C14H14ClN3O4S2.
What is the molecular weight of Benzylhydrochlorothiazide?
The molecular weight of Benzylhydrochlorothiazide is 387.01 g/mol.
Where can I buy Benzylhydrochlorothiazide?
You can request a quote for Benzylhydrochlorothiazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylhydrochlorothiazide?
Yes, KEHONG BIO provides custom synthesis services for Benzylhydrochlorothiazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.