N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide
TL;DR: N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide (CAS 701290-46-2) is a chemical compound with molecular formula C17H17NO3 and molecular weight 283.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide
Also Known As: N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide, N-(2H-1,3-benzodioxol-5-yl)-3-phenylbutanamide, N-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)-3-phenylbutanamide
| Molecular Formula | C17H17NO3 |
|---|---|
| Molecular Weight | 283.12 g/mol |
| LogP | 3.5476 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.12085 |
| Heavy Atoms | 21 |
| Complexity | 639.7384 |
Chemical Identifiers
| CAS Number | 701290-46-2 |
|---|---|
| SMILES | CC(CC(=O)NC1=CC2=C(C=C1)OCO2)C3=CC=CC=C3 |
Product Overview
N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide (CAS 701290-46-2), with molecular formula C17H17NO3 and molecular weight 283.12 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide
Property Insights of N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide
The XLogP value of 3.5476 indicates that N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide 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)-3-phenylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide has 1 hydrogen bond donor(s) and 3 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)-3-phenylbutanamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide is 701290-46-2.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide is C17H17NO3.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide is 283.12 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide 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)-3-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-3-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.