4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine
TL;DR: 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine (CAS 224640-03-3) is a chemical compound with molecular formula C6H4ClN3OS2 and molecular weight 232.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(5-methyl-1,2-oxazol-3-yl)dithiazol-5-imine
Also Known As: J1.072.908D, 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)dithiazol-5-imine, 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine, 5-Methyl-N-(4-chloro-5H-1,2,3-dithiazole-5-ylidene)isoxazole-3-amine, N-(4-Chloro-5H-1,2,3-dithiazol-5-ylidene)-5-methyl-3-isoxazolamine
| Molecular Formula | C6H4ClN3OS2 |
|---|---|
| Molecular Weight | 232.95 g/mol |
| LogP | 2.38682 |
| Topological Polar Surface Area | 51.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.94843 |
| Heavy Atoms | 13 |
| Complexity | 471.9328 |
Chemical Identifiers
| CAS Number | 224640-03-3 |
|---|---|
| SMILES | CC1=CC(=NO1)N=C2C(=NSS2)Cl |
Product Overview
4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine (CAS 224640-03-3), with molecular formula C6H4ClN3OS2 and molecular weight 232.95 g/mol. IUPAC: 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)dithiazol-5-imine.
Chemical Property Profile of 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine
Property Insights of 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine
The XLogP value of 2.38682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine. With a topological polar surface area (TPSA) of 51.28 Ų, 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine has 0 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-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine?
The CAS number of 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine is 224640-03-3.
What is the molecular formula of 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine?
The molecular formula of 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine is C6H4ClN3OS2.
What is the molecular weight of 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine?
The molecular weight of 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine is 232.95 g/mol.
Where can I buy 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine?
You can request a quote for 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(5-methyl-1,2-oxazol-3-yl)-5H-1,2,3-dithiazol-5-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.