(Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile
TL;DR: (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile (CAS 112672-50-1) is a chemical compound with molecular formula C17H12N4S and molecular weight 304.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-N-anilino-4-phenyl-1,3-thiazole-2-carboximidoyl cyanide
Also Known As: AB00077367-01, (Phenyl-hydrazono)-(4-phenyl-thiazol-2-yl)-acetonitrile, 1-(4-phenylthiazol-2-yl)-1-phenylhydrazoglyoxalonitrile, (phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile, (2E)-N-anilino-4-phenyl-1,3-thiazole-2-carboximidoyl cyanide
| Molecular Formula | C17H12N4S |
|---|---|
| Molecular Weight | 304.08 g/mol |
| LogP | 4.14988 |
| Topological Polar Surface Area | 61.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.07828 |
| Heavy Atoms | 22 |
| Complexity | 816.6251 |
Chemical Identifiers
| CAS Number | 112672-50-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CSC(=N2)/C(=N/NC3=CC=CC=C3)/C#N |
Product Overview
(Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile (CAS 112672-50-1), with molecular formula C17H12N4S and molecular weight 304.08 g/mol. IUPAC: (2E)-N-anilino-4-phenyl-1,3-thiazole-2-carboximidoyl cyanide.
Chemical Property Profile of (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile
Property Insights of (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile
The XLogP value of 4.14988 indicates that (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.07 Ų falls within the moderate polarity range, balancing permeability and solubility for (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile. Following Lipinski's Rule of Five, (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile has 1 hydrogen bond donor(s) and 5 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 (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
The CAS number of (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile is 112672-50-1.
What is the molecular formula of (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
The molecular formula of (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile is C17H12N4S.
What is the molecular weight of (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
The molecular weight of (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile is 304.08 g/mol.
Where can I buy (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
You can request a quote for (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Phenylhydrazono)(4-phenyl-1,3-thiazol-2-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.