N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide (CAS 433688-45-0) is a chemical compound with molecular formula C14H12INO4S and molecular weight 416.95 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-iodobenzenesulfonamide
Also Known As: AB00040741-01, N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide, (2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)[(4-iodophenyl)sulfonyl]amine
| Molecular Formula | C14H12INO4S |
|---|---|
| Molecular Weight | 416.95 g/mol |
| LogP | 2.4984 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.9532 |
| Heavy Atoms | 21 |
| Complexity | 759.0435 |
Chemical Identifiers
| CAS Number | 433688-45-0 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)I |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide (CAS 433688-45-0), with molecular formula C14H12INO4S and molecular weight 416.95 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide
The XLogP value of 2.4984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide 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-iodobenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide is 433688-45-0.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide is C14H12INO4S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide is 416.95 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide 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-iodobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-iodobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.