N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide
TL;DR: N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide (CAS 848057-72-7) is a chemical compound with molecular formula C18H19NO3 and molecular weight 297.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide
Also Known As: N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide, N-(2-sec-butylphenyl)-1,3-benzodioxole-5-carboxamide, AN-652/41152300
| Molecular Formula | C18H19NO3 |
|---|---|
| Molecular Weight | 297.14 g/mol |
| LogP | 4.1811 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.1365 |
| Heavy Atoms | 22 |
| Complexity | 696.4817 |
Chemical Identifiers
| CAS Number | 848057-72-7 |
|---|---|
| SMILES | CCC(C)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)OCO3 |
Product Overview
N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide (CAS 848057-72-7), with molecular formula C18H19NO3 and molecular weight 297.14 g/mol. IUPAC: N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide
Property Insights of N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide
The XLogP value of 4.1811 indicates that N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide 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-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide 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-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide?
The CAS number of N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide is 848057-72-7.
What is the molecular formula of N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide is C18H19NO3.
What is the molecular weight of N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide is 297.14 g/mol.
Where can I buy N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-butan-2-ylphenyl)-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.