Hydrochlorothiazide Impurity 31
TL;DR: Hydrochlorothiazide Impurity 31 (CAS 890-67-5) is a chemical compound with molecular formula C8H10ClN3O4S2 and molecular weight 310.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-methyl-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
Also Known As: Methiazide, Hydrochlorothiazide Impurity 31, Hydrochlorothiazide Impurity F, Hydrochlorothiazide impurity 45, 3-METHYLHYDROCHLOROTHIAZIDE
| Molecular Formula | C8H10ClN3O4S2 |
|---|---|
| Molecular Weight | 310.98 g/mol |
| LogP | 0.0372 |
| Topological Polar Surface Area | 118.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 310.98013 |
| Heavy Atoms | 18 |
| Complexity | 714.1028 |
Chemical Identifiers
| CAS Number | 890-67-5 |
|---|---|
| SMILES | CC1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl |
Product Overview
Hydrochlorothiazide Impurity 31 (CAS 890-67-5), with molecular formula C8H10ClN3O4S2 and molecular weight 310.98 g/mol. IUPAC: 6-chloro-3-methyl-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide.
Chemical Property Profile of Hydrochlorothiazide Impurity 31
Property Insights of Hydrochlorothiazide Impurity 31
The XLogP value of 0.0372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrochlorothiazide Impurity 31. The TPSA of 118.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydrochlorothiazide Impurity 31. Following Lipinski's Rule of Five, Hydrochlorothiazide Impurity 31 has 3 hydrogen bond donor(s) and 5 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 Impurity 31?
The CAS number of Hydrochlorothiazide Impurity 31 is 890-67-5.
What is the molecular formula of Hydrochlorothiazide Impurity 31?
The molecular formula of Hydrochlorothiazide Impurity 31 is C8H10ClN3O4S2.
What is the molecular weight of Hydrochlorothiazide Impurity 31?
The molecular weight of Hydrochlorothiazide Impurity 31 is 310.98 g/mol.
Where can I buy Hydrochlorothiazide Impurity 31?
You can request a quote for Hydrochlorothiazide Impurity 31 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrochlorothiazide Impurity 31?
Yes, KEHONG BIO provides custom synthesis services for Hydrochlorothiazide Impurity 31 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.