N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide
TL;DR: N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide (CAS 712293-10-2) is a chemical compound with molecular formula C22H17ClN2OS2 and molecular weight 424.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-(4-chlorophenyl)sulfanylacetamide
Also Known As: N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide, N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-(4-chlorophenyl)sulfanylacetamide, N-[(4-benzothiazol-2-ylphenyl)methyl]-2-(4-chlorophenyl)sulfanyl-acetamide
| Molecular Formula | C22H17ClN2OS2 |
|---|---|
| Molecular Weight | 424.05 g/mol |
| LogP | 6.0252 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.0471 |
| Heavy Atoms | 28 |
| Complexity | 1058.6927 |
Chemical Identifiers
| CAS Number | 712293-10-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)CNC(=O)CSC4=CC=C(C=C4)Cl |
Product Overview
N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide (CAS 712293-10-2), with molecular formula C22H17ClN2OS2 and molecular weight 424.05 g/mol. IUPAC: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-2-(4-chlorophenyl)sulfanylacetamide.
Chemical Property Profile of N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide
Property Insights of N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide
The XLogP value of 6.0252 indicates that N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide 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-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide?
The CAS number of N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide is 712293-10-2.
What is the molecular formula of N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide?
The molecular formula of N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide is C22H17ClN2OS2.
What is the molecular weight of N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide?
The molecular weight of N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide is 424.05 g/mol.
Where can I buy N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide?
You can request a quote for N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(1,3-benzothiazol-2-yl)benzyl]-2-[(4-chlorophenyl)sulfanyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.