4-Nitrosohydrochlorothiazide
TL;DR: 4-Nitrosohydrochlorothiazide (CAS 63779-86-2) is a chemical compound with molecular formula C7H7ClN4O5S2 and molecular weight 325.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-nitroso-1,1-dioxo-2,3-dihydro-1λ6,2,4-benzothiadiazine-7-sulfonamide
Also Known As: 4-Nitroso-hct, 4-Nitrosohydrochlorothiazide, N-Nitroso Hydrochlorothiazide, N-Nitroso-hydrochlorothiazide, Nitroso Hydrochlorothiazide
| Molecular Formula | C7H7ClN4O5S2 |
|---|---|
| Molecular Weight | 325.95 g/mol |
| LogP | -0.2754 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.95465 |
| Heavy Atoms | 19 |
| Complexity | 759.9376 |
Chemical Identifiers
| CAS Number | 63779-86-2 |
|---|---|
| SMILES | C1NS(=O)(=O)C2=CC(=C(C=C2N1N=O)Cl)S(=O)(=O)N |
Product Overview
4-Nitrosohydrochlorothiazide (CAS 63779-86-2), with molecular formula C7H7ClN4O5S2 and molecular weight 325.95 g/mol. IUPAC: 6-chloro-4-nitroso-1,1-dioxo-2,3-dihydro-1λ6,2,4-benzothiadiazine-7-sulfonamide.
Chemical Property Profile of 4-Nitrosohydrochlorothiazide
Property Insights of 4-Nitrosohydrochlorothiazide
The XLogP value of -0.2754 indicates that 4-Nitrosohydrochlorothiazide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrosohydrochlorothiazide. Following Lipinski's Rule of Five, 4-Nitrosohydrochlorothiazide has 2 hydrogen bond donor(s) and 6 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 4-Nitrosohydrochlorothiazide?
The CAS number of 4-Nitrosohydrochlorothiazide is 63779-86-2.
What is the molecular formula of 4-Nitrosohydrochlorothiazide?
The molecular formula of 4-Nitrosohydrochlorothiazide is C7H7ClN4O5S2.
What is the molecular weight of 4-Nitrosohydrochlorothiazide?
The molecular weight of 4-Nitrosohydrochlorothiazide is 325.95 g/mol.
Where can I buy 4-Nitrosohydrochlorothiazide?
You can request a quote for 4-Nitrosohydrochlorothiazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrosohydrochlorothiazide?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrosohydrochlorothiazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.