N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate
TL;DR: N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate (CAS 7234-55-1) is a chemical compound with molecular formula C15H10N3OS2- and molecular weight 312.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate
Also Known As: N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate, 1,3-Methanocyclopropa[1,5]cyclopent[1,2-b]indole(8CI,9CI), N-[3-(Phenylimino)-3H-1,2,4-dithiazol-5-yl]benzenecarboximidate
| Molecular Formula | C15H10N3OS2- |
|---|---|
| Molecular Weight | 312.03 g/mol |
| LogP | 2.8756 |
| Topological Polar Surface Area | 60.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.02652 |
| Heavy Atoms | 21 |
| Complexity | 807.4498 |
Chemical Identifiers
| CAS Number | 7234-55-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NC2=NC(=NC3=CC=CC=C3)SS2)[O-] |
Product Overview
N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate (CAS 7234-55-1), with molecular formula C15H10N3OS2- and molecular weight 312.03 g/mol. IUPAC: N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate.
Chemical Property Profile of N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate
Property Insights of N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate
The XLogP value of 2.8756 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate. The TPSA of 60.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate. Following Lipinski's Rule of Five, N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate 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 N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate?
The CAS number of N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate is 7234-55-1.
What is the molecular formula of N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate?
The molecular formula of N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate is C15H10N3OS2-.
What is the molecular weight of N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate?
The molecular weight of N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate is 312.03 g/mol.
Where can I buy N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate?
You can request a quote for N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate?
Yes, KEHONG BIO provides custom synthesis services for N-(5-phenylimino-1,2,4-dithiazol-3-yl)benzenecarboximidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.