N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide
TL;DR: N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide (CAS 879030-62-3) is a chemical compound with molecular formula C17H16ClNO4 and molecular weight 333.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide
Also Known As: ASN 14215512, N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide, N-Benzo[1,3]dioxol-5-yl-2-(4-chloro-phenoxy)-butyramide
| Molecular Formula | C17H16ClNO4 |
|---|---|
| Molecular Weight | 333.08 g/mol |
| LogP | 3.8648 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.07678 |
| Heavy Atoms | 23 |
| Complexity | 702.2396 |
Chemical Identifiers
| CAS Number | 879030-62-3 |
|---|---|
| SMILES | CCC(C(=O)NC1=CC2=C(C=C1)OCO2)OC3=CC=C(C=C3)Cl |
Product Overview
N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide (CAS 879030-62-3), with molecular formula C17H16ClNO4 and molecular weight 333.08 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide
Property Insights of N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide
The XLogP value of 3.8648 indicates that N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.79 Ų, N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide 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-yl)-2-(4-chlorophenoxy)butanamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide is 879030-62-3.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide is C17H16ClNO4.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide is 333.08 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide 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)-2-(4-chlorophenoxy)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-2-(4-chlorophenoxy)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.