N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide (CAS 617676-01-4) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-yloxybenzamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide, N-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-yloxybenzamide
| Molecular Formula | C18H19NO4 |
|---|---|
| Molecular Weight | 313.13 g/mol |
| LogP | 3.1325 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.1314 |
| Heavy Atoms | 23 |
| Complexity | 694.6678 |
Chemical Identifiers
| CAS Number | 617676-01-4 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide (CAS 617676-01-4), with molecular formula C18H19NO4 and molecular weight 313.13 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-yloxybenzamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide
The XLogP value of 3.1325 indicates that N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide 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-ylmethyl)-4-(propan-2-yloxy)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide 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-ylmethyl)-4-(propan-2-yloxy)benzamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide is 617676-01-4.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide is C18H19NO4.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide is 313.13 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)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-ylmethyl)-4-(propan-2-yloxy)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-(propan-2-yloxy)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.