![N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide structure](/static/products/4452/445226-56-2.webp)
N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide
TL;DR: N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide (CAS 445226-56-2) is a chemical compound with molecular formula C22H19NO3S and molecular weight 377.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-4-[(4-methylphenyl)sulfanylmethyl]benzamide
Also Known As: N-1,3-Benzodioxol-5-yl-4-[[(4-methylphenyl)thio]methyl]benzamide, N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide, N-(1,3-benzodioxol-5-yl)-4-[(4-methylphenyl)sulfanylmethyl]benzamide
| Molecular Formula | C22H19NO3S |
|---|---|
| Molecular Weight | 377.11 g/mol |
| LogP | 5.26832 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 377.10855 |
| Heavy Atoms | 27 |
| Complexity | 952.2968 |
Chemical Identifiers
| CAS Number | 445226-56-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NC3=CC4=C(C=C3)OCO4 |
Product Overview
N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide (CAS 445226-56-2), with molecular formula C22H19NO3S and molecular weight 377.11 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-4-[(4-methylphenyl)sulfanylmethyl]benzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide
Property Insights of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide
The XLogP value of 5.26832 indicates that N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide is 445226-56-2.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide is C22H19NO3S.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide is 377.11 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide 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-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-4-{[(4-methylphenyl)sulfanyl]methyl}benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.