N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide
TL;DR: N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide (CAS 404838-00-2) is a chemical compound with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide
Also Known As: KSC-09-224F, BAS 02976126, N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide, N-Benzothiazol-2-yl-2-(4-chloro-phenoxy)-propionamide
| Molecular Formula | C16H13ClN2O2S |
|---|---|
| Molecular Weight | 332.04 g/mol |
| LogP | 4.3557 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.03864 |
| Heavy Atoms | 22 |
| Complexity | 768.2708 |
Chemical Identifiers
| CAS Number | 404838-00-2 |
|---|---|
| SMILES | CC(C(=O)NC1=NC2=CC=CC=C2S1)OC3=CC=C(C=C3)Cl |
Product Overview
N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide (CAS 404838-00-2), with molecular formula C16H13ClN2O2S and molecular weight 332.04 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide.
Chemical Property Profile of N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide
Property Insights of N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide
The XLogP value of 4.3557 indicates that N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide 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-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide?
The CAS number of N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide is 404838-00-2.
What is the molecular formula of N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide?
The molecular formula of N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide is C16H13ClN2O2S.
What is the molecular weight of N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide?
The molecular weight of N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide is 332.04 g/mol.
Where can I buy N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide?
You can request a quote for N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide 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-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenoxy)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.