1-phenyl-N-phenylsulfanylmethanimine
TL;DR: 1-phenyl-N-phenylsulfanylmethanimine (CAS 52777-99-8) is a chemical compound with molecular formula C13H11NS and molecular weight 213.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-N-phenylsulfanylmethanimine
Also Known As: Benzaldehyde S-phenylthioxime, 1-phenyl-N-phenylsulfanylmethanimine, (Z)-1-phenyl-N-phenylsulfanylmethanimine
| Molecular Formula | C13H11NS |
|---|---|
| Molecular Weight | 213.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 37.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.06122 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 52777-99-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=NSC2=CC=CC=C2 |
| InChIKey | ZKNRVOCALMUANN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-phenyl-N-phenylsulfanylmethanimine (CAS 52777-99-8), with molecular formula C13H11NS and molecular weight 213.06 g/mol. IUPAC: 1-phenyl-N-phenylsulfanylmethanimine.
Chemical Property Profile of 1-phenyl-N-phenylsulfanylmethanimine
Property Insights of 1-phenyl-N-phenylsulfanylmethanimine
The XLogP value of 3.7 indicates that 1-phenyl-N-phenylsulfanylmethanimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.7 Ų, 1-phenyl-N-phenylsulfanylmethanimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-phenyl-N-phenylsulfanylmethanimine has 0 hydrogen bond donor(s) and 2 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 1-phenyl-N-phenylsulfanylmethanimine?
The CAS number of 1-phenyl-N-phenylsulfanylmethanimine is 52777-99-8.
What is the molecular formula of 1-phenyl-N-phenylsulfanylmethanimine?
The molecular formula of 1-phenyl-N-phenylsulfanylmethanimine is C13H11NS.
What is the molecular weight of 1-phenyl-N-phenylsulfanylmethanimine?
The molecular weight of 1-phenyl-N-phenylsulfanylmethanimine is 213.06 g/mol.
Where can I buy 1-phenyl-N-phenylsulfanylmethanimine?
You can request a quote for 1-phenyl-N-phenylsulfanylmethanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-phenyl-N-phenylsulfanylmethanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-phenyl-N-phenylsulfanylmethanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.