N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide (CAS 433697-12-2) is a chemical compound with molecular formula C17H19NO4S and molecular weight 333.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-ylbenzenesulfonamide
Also Known As: BAS 03391479, N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide, UPCMLD0ENAT5942546:001, N-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-ylbenzenesulfonamide, AP-263/40917594
| Molecular Formula | C17H19NO4S |
|---|---|
| Molecular Weight | 333.10 g/mol |
| LogP | 3.0172 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.1035 |
| Heavy Atoms | 23 |
| Complexity | 797.84314 |
Chemical Identifiers
| CAS Number | 433697-12-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide (CAS 433697-12-2), with molecular formula C17H19NO4S and molecular weight 333.10 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-ylbenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide
The XLogP value of 3.0172 indicates that N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide 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-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide is 433697-12-2.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide is C17H19NO4S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide is 333.10 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-isopropylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.