4-chloro-N-phenyldithiazol-5-imine
TL;DR: 4-chloro-N-phenyldithiazol-5-imine (CAS 65342-88-3) is a chemical compound with molecular formula C8H5ClN2S2 and molecular weight 227.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-phenyldithiazol-5-imine
Also Known As: 4-chloro-N-phenyldithiazol-5-imine, 4-chloro-N-phenyl-5-dithiazolimine, 4-chloro-N-phenyl-dithiazol-5-imine, (4-chlorodithiazol-5-ylidene)-phenyl-amine, N-(4-chloro-5h-1,2,3-dithiazol-5-ylidene)aniline
| Molecular Formula | C8H5ClN2S2 |
|---|---|
| Molecular Weight | 227.96 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 227.95827 |
| Heavy Atoms | 13 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 65342-88-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=C2C(=NSS2)Cl |
| InChIKey | VBEGPXRLUXVFCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-chloro-N-phenyldithiazol-5-imine (CAS 65342-88-3), with molecular formula C8H5ClN2S2 and molecular weight 227.96 g/mol. IUPAC: 4-chloro-N-phenyldithiazol-5-imine.
Chemical Property Profile of 4-chloro-N-phenyldithiazol-5-imine
Property Insights of 4-chloro-N-phenyldithiazol-5-imine
The XLogP value of 3.5 indicates that 4-chloro-N-phenyldithiazol-5-imine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-phenyldithiazol-5-imine. Following Lipinski's Rule of Five, 4-chloro-N-phenyldithiazol-5-imine has 0 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 4-chloro-N-phenyldithiazol-5-imine?
The CAS number of 4-chloro-N-phenyldithiazol-5-imine is 65342-88-3.
What is the molecular formula of 4-chloro-N-phenyldithiazol-5-imine?
The molecular formula of 4-chloro-N-phenyldithiazol-5-imine is C8H5ClN2S2.
What is the molecular weight of 4-chloro-N-phenyldithiazol-5-imine?
The molecular weight of 4-chloro-N-phenyldithiazol-5-imine is 227.96 g/mol.
Where can I buy 4-chloro-N-phenyldithiazol-5-imine?
You can request a quote for 4-chloro-N-phenyldithiazol-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-phenyldithiazol-5-imine?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-phenyldithiazol-5-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.