N-allylpropane-1-sulfonamide
TL;DR: N-allylpropane-1-sulfonamide (CAS 1022796-76-4) is a chemical compound with molecular formula C6H13NO2S and molecular weight 163.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-prop-2-enylpropane-1-sulfonamide
Also Known As: N-allylpropane-1-sulfonamide, N-prop-2-enylpropane-1-sulfonamide, N-2-propen-1-yl-1-Propanesulfonamide, 1(3H)-Isobenzofuranone,3,3-bis[4-(methylamino)phenyl]
| Molecular Formula | C6H13NO2S |
|---|---|
| Molecular Weight | 163.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 54.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 163.0667 |
| Heavy Atoms | 10 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 1022796-76-4 |
|---|---|
| SMILES | CCCS(=O)(=O)NCC=C |
| InChIKey | OYKIPRJZFZTCTK-UHFFFAOYSA-N |
Product Overview
N-allylpropane-1-sulfonamide (CAS 1022796-76-4), with molecular formula C6H13NO2S and molecular weight 163.07 g/mol. IUPAC: N-prop-2-enylpropane-1-sulfonamide.
Chemical Property Profile of N-allylpropane-1-sulfonamide
Property Insights of N-allylpropane-1-sulfonamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-allylpropane-1-sulfonamide. With a topological polar surface area (TPSA) of 54.6 Ų, N-allylpropane-1-sulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allylpropane-1-sulfonamide has 1 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-allylpropane-1-sulfonamide?
The CAS number of N-allylpropane-1-sulfonamide is 1022796-76-4.
What is the molecular formula of N-allylpropane-1-sulfonamide?
The molecular formula of N-allylpropane-1-sulfonamide is C6H13NO2S.
What is the molecular weight of N-allylpropane-1-sulfonamide?
The molecular weight of N-allylpropane-1-sulfonamide is 163.07 g/mol.
Where can I buy N-allylpropane-1-sulfonamide?
You can request a quote for N-allylpropane-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allylpropane-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-allylpropane-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.