N-亚磺酰基苯胺
TL;DR: N-亚磺酰基苯胺 (CAS 1122-83-4) is a chemical compound with molecular formula C6H5NOS and molecular weight 139.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-亚磺酰基苯胺
(sulfinylamino)benzene
Also Known As: N-Thionylaniline, N-Sulfinylaniline, Thionylaniline, Phenylsulfinylamine, Benzenamine, N-sulfinyl-
| Molecular Formula | C6H5NOS |
|---|---|
| Molecular Weight | 139.01 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 30.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.00919 |
| Heavy Atoms | 9 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 1122-83-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N=S=O |
| InChIKey | FIOJWGRGPONADF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-亚磺酰基苯胺 (CAS 1122-83-4), with molecular formula C6H5NOS and molecular weight 139.01 g/mol. IUPAC: (sulfinylamino)benzene.
Chemical Property Profile of N-亚磺酰基苯胺
Property Insights of N-亚磺酰基苯胺
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-亚磺酰基苯胺. With a topological polar surface area (TPSA) of 30.4 Ų, N-亚磺酰基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-亚磺酰基苯胺 has 0 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 N-亚磺酰基苯胺?
The CAS number of N-亚磺酰基苯胺 is 1122-83-4.
What is the molecular formula of N-亚磺酰基苯胺?
The molecular formula of N-亚磺酰基苯胺 is C6H5NOS.
What is the molecular weight of N-亚磺酰基苯胺?
The molecular weight of N-亚磺酰基苯胺 is 139.01 g/mol.
Where can I buy N-亚磺酰基苯胺?
You can request a quote for N-亚磺酰基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-亚磺酰基苯胺?
Yes, KEHONG BIO provides custom synthesis services for N-亚磺酰基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.