CAS 113367-93-4 - C16H16N6S
TL;DR: CAS 113367-93-4 - C16H16N6S (CAS 113367-93-4) is a chemical compound with molecular formula C16H16N6S and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-benzylthiourea
Also Known As: N-{[2-(1H-1,3-Benzimidazol-2-yl)hydrazin-1-yl]methylidene}-N'-benzylcarbamimidothioic acid, N-{[2-(1H-Benzimidazol-2-yl)hydrazinyl]methylidene}-N'-benzylcarbamimidothioic acid
| Molecular Formula | C16H16N6S |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 2.5824 |
| Topological Polar Surface Area | 77.13 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.11572 |
| Heavy Atoms | 23 |
| Complexity | 778.56323 |
Chemical Identifiers
| CAS Number | 113367-93-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=S)N=CNNC2=NC3=CC=CC=C3N2 |
Product Overview
CAS 113367-93-4 - C16H16N6S (CAS 113367-93-4), with molecular formula C16H16N6S and molecular weight 324.12 g/mol. IUPAC: 1-[[2-(1H-benzimidazol-2-yl)hydrazinyl]methylidene]-3-benzylthiourea.
Chemical Property Profile of CAS 113367-93-4 - C16H16N6S
Property Insights of CAS 113367-93-4 - C16H16N6S
The XLogP value of 2.5824 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CAS 113367-93-4 - C16H16N6S. The TPSA of 77.13 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 113367-93-4 - C16H16N6S. Following Lipinski's Rule of Five, CAS 113367-93-4 - C16H16N6S has 4 hydrogen bond donor(s) and 3 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 CAS 113367-93-4 - C16H16N6S?
The CAS number of CAS 113367-93-4 - C16H16N6S is 113367-93-4.
What is the molecular formula of CAS 113367-93-4 - C16H16N6S?
The molecular formula of CAS 113367-93-4 - C16H16N6S is C16H16N6S.
What is the molecular weight of CAS 113367-93-4 - C16H16N6S?
The molecular weight of CAS 113367-93-4 - C16H16N6S is 324.12 g/mol.
Where can I buy CAS 113367-93-4 - C16H16N6S?
You can request a quote for CAS 113367-93-4 - C16H16N6S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 113367-93-4 - C16H16N6S?
Yes, KEHONG BIO provides custom synthesis services for CAS 113367-93-4 - C16H16N6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.