Bionet1_000300
TL;DR: Bionet1_000300 (CAS 338976-83-3) is a chemical compound with molecular formula C13H8ClN5O2S2 and molecular weight 364.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloroanilino)-1-[(4-cyano-5-methyl-1,2-thiazol-3-yl)sulfonyl]methanimidoyl cyanide
Also Known As: Bionet1_000300, DivK1c_002316, CDS1_001276, 3-{[2-(4-chlorophenyl)(cyano)carbohydrazonoyl]sulfonyl}-5-methyl-4-isothiazolecarbonitrile, N-(4-chloroanilino)-1-[(4-cyano-5-methyl-1,2-thiazol-3-yl)sulfonyl]methanimidoyl cyanide
| Molecular Formula | C13H8ClN5O2S2 |
|---|---|
| Molecular Weight | 364.98 g/mol |
| LogP | 2.69948 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.9808 |
| Heavy Atoms | 23 |
| Complexity | 949.73157 |
Chemical Identifiers
| CAS Number | 338976-83-3 |
|---|---|
| SMILES | CC1=C(C(=NS1)S(=O)(=O)C(=NNC2=CC=C(C=C2)Cl)C#N)C#N |
Product Overview
Bionet1_000300 (CAS 338976-83-3), with molecular formula C13H8ClN5O2S2 and molecular weight 364.98 g/mol. IUPAC: N-(4-chloroanilino)-1-[(4-cyano-5-methyl-1,2-thiazol-3-yl)sulfonyl]methanimidoyl cyanide.
Chemical Property Profile of Bionet1_000300
Property Insights of Bionet1_000300
The XLogP value of 2.69948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_000300. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_000300. Following Lipinski's Rule of Five, Bionet1_000300 has 1 hydrogen bond donor(s) and 8 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 Bionet1_000300?
The CAS number of Bionet1_000300 is 338976-83-3.
What is the molecular formula of Bionet1_000300?
The molecular formula of Bionet1_000300 is C13H8ClN5O2S2.
What is the molecular weight of Bionet1_000300?
The molecular weight of Bionet1_000300 is 364.98 g/mol.
Where can I buy Bionet1_000300?
You can request a quote for Bionet1_000300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_000300?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_000300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.