RefChem:1069511
TL;DR: RefChem:1069511 (CAS 21889-04-3) is a chemical compound with molecular formula C10H14ClN3OS and molecular weight 259.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dimethyl-3-oxido-2-pyridin-4-yl-5,6-dihydro-1,3,4-thiadiazin-3-ium;hydrochloride
Also Known As: 5,6-Dihydro-4,6-dimethyl-2-(1-oxide-4-pyridyl)-4H-1,3,4-thiadiazine hydrochloride, 4,6-dimethyl-2-(pyridin-4-yl)-5,6-dihydro-4h-1,3,4-thiadiazine 3-oxide hydrochloride(1:1), 4,6-Dimethyl-2-(1-oxide-4-pyridyl)-5,6-dihydro-4H-1,3,4-thiadiazine hydrochloride, 4H-1,3,4-Thiadiazine, 5,6-dihydro-4,6-dimethyl-2-(1-oxide-4-pyridyl)-, hydrochloride, 4,6-dimethyl-3-oxido-2-pyridin-4-yl-5,6-dihydro-1,3,4-thiadiazin-3-ium hydrochloride
| Molecular Formula | C10H14ClN3OS |
|---|---|
| Molecular Weight | 259.05 g/mol |
| LogP | 1.7424 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.0546 |
| Heavy Atoms | 16 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 21889-04-3 |
|---|---|
| SMILES | CC1CN([N+](=C(S1)C2=CC=NC=C2)[O-])C.Cl |
| InChIKey | LZDKDODZTAHMMJ-UHFFFAOYSA-N |
Product Overview
RefChem:1069511 (CAS 21889-04-3), with molecular formula C10H14ClN3OS and molecular weight 259.05 g/mol. IUPAC: 4,6-dimethyl-3-oxido-2-pyridin-4-yl-5,6-dihydro-1,3,4-thiadiazin-3-ium;hydrochloride.
Chemical Property Profile of RefChem:1069511
Property Insights of RefChem:1069511
The XLogP value of 1.7424 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1069511. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1069511. Following Lipinski's Rule of Five, RefChem:1069511 has 1 hydrogen bond donor(s) and 4 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 RefChem:1069511?
The CAS number of RefChem:1069511 is 21889-04-3.
What is the molecular formula of RefChem:1069511?
The molecular formula of RefChem:1069511 is C10H14ClN3OS.
What is the molecular weight of RefChem:1069511?
The molecular weight of RefChem:1069511 is 259.05 g/mol.
Where can I buy RefChem:1069511?
You can request a quote for RefChem:1069511 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1069511?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1069511 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.