双硫腙
TL;DR: 双硫腙 (CAS 760132-01-2) is a chemical compound with molecular formula C13H12N4S and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双硫腙
1-anilino-3-phenyliminothiourea
Also Known As: DITHIZONE, Diphenylthiocarbazone, Dithizon, Ditizon, Dithizone E-form
| Molecular Formula | C13H12N4S |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.07828 |
| Heavy Atoms | 18 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 760132-01-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NNC(=S)N=NC2=CC=CC=C2 |
| InChIKey | UOFGSWVZMUXXIY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双硫腙 (CAS 760132-01-2), with molecular formula C13H12N4S and molecular weight 256.08 g/mol. IUPAC: 1-anilino-3-phenyliminothiourea.
Chemical Property Profile of 双硫腙
Property Insights of 双硫腙
The XLogP value of 4.2 indicates that 双硫腙 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 双硫腙. Following Lipinski's Rule of Five, 双硫腙 has 2 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 双硫腙?
The CAS number of 双硫腙 is 760132-01-2.
What is the molecular formula of 双硫腙?
The molecular formula of 双硫腙 is C13H12N4S.
What is the molecular weight of 双硫腙?
The molecular weight of 双硫腙 is 256.08 g/mol.
Where can I buy 双硫腙?
You can request a quote for 双硫腙 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双硫腙?
Yes, KEHONG BIO provides custom synthesis services for 双硫腙 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.