n-(Phenylsulfanyl)propan-2-imine
TL;DR: n-(Phenylsulfanyl)propan-2-imine (CAS 3846-28-4) is a chemical compound with molecular formula C9H11NS and molecular weight 165.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-phenylsulfanylpropan-2-imine
Also Known As: n-(phenylsulfanyl)propan-2-imine, N-phenylsulfanylpropan-2-imine, Propan-2-one (S-phenylthioxime), N-Isopropylidene-benzenesulfenamide, N-propan-2-ylidenebenzenesulfenamide
| Molecular Formula | C9H11NS |
|---|---|
| Molecular Weight | 165.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 37.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.06122 |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 3846-28-4 |
|---|---|
| SMILES | CC(=NSC1=CC=CC=C1)C |
| InChIKey | DZXGPEWLIHOSRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
n-(Phenylsulfanyl)propan-2-imine (CAS 3846-28-4), with molecular formula C9H11NS and molecular weight 165.06 g/mol. IUPAC: N-phenylsulfanylpropan-2-imine.
Chemical Property Profile of n-(Phenylsulfanyl)propan-2-imine
Property Insights of n-(Phenylsulfanyl)propan-2-imine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(Phenylsulfanyl)propan-2-imine. With a topological polar surface area (TPSA) of 37.7 Ų, n-(Phenylsulfanyl)propan-2-imine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-(Phenylsulfanyl)propan-2-imine 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 n-(Phenylsulfanyl)propan-2-imine?
The CAS number of n-(Phenylsulfanyl)propan-2-imine is 3846-28-4.
What is the molecular formula of n-(Phenylsulfanyl)propan-2-imine?
The molecular formula of n-(Phenylsulfanyl)propan-2-imine is C9H11NS.
What is the molecular weight of n-(Phenylsulfanyl)propan-2-imine?
The molecular weight of n-(Phenylsulfanyl)propan-2-imine is 165.06 g/mol.
Where can I buy n-(Phenylsulfanyl)propan-2-imine?
You can request a quote for n-(Phenylsulfanyl)propan-2-imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-(Phenylsulfanyl)propan-2-imine?
Yes, KEHONG BIO provides custom synthesis services for n-(Phenylsulfanyl)propan-2-imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.