N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide
TL;DR: N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide (CAS 42860-53-7) is a chemical compound with molecular formula C13H12ClNO2S and molecular weight 281.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-phenylmethoxybenzenesulfinamide
Also Known As: 4-chloro-N-phenylmethoxybenzenesulfinamide, N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide
| Molecular Formula | C13H12ClNO2S |
|---|---|
| Molecular Weight | 281.03 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 281.02774 |
| Heavy Atoms | 18 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 42860-53-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CONS(=O)C2=CC=C(C=C2)Cl |
| InChIKey | SHVWRTHQXSVKCB-UHFFFAOYSA-N |
Product Overview
N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide (CAS 42860-53-7), with molecular formula C13H12ClNO2S and molecular weight 281.03 g/mol. IUPAC: 4-chloro-N-phenylmethoxybenzenesulfinamide.
Chemical Property Profile of N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide
Property Insights of N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide
The XLogP value of 3.6 indicates that N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide has 1 hydrogen bond donor(s) and 4 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-(Benzyloxy)-4-chlorobenzene-1-sulfinamide?
The CAS number of N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide is 42860-53-7.
What is the molecular formula of N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide?
The molecular formula of N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide is C13H12ClNO2S.
What is the molecular weight of N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide?
The molecular weight of N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide is 281.03 g/mol.
Where can I buy N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide?
You can request a quote for N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(Benzyloxy)-4-chlorobenzene-1-sulfinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.