N-tert-butyl-4-propoxybenzamide
TL;DR: N-tert-butyl-4-propoxybenzamide (CAS 876179-63-4) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-4-propoxybenzamide
Also Known As: N-tert-butyl-4-propoxybenzamide, N-(tert-butyl)-4-propoxybenzamide, N-(tert-butyl)(4-propoxyphenyl)carboxamide
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 3.0037 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 362.80374 |
Chemical Identifiers
| CAS Number | 876179-63-4 |
|---|---|
| SMILES | CCCOC1=CC=C(C=C1)C(=O)NC(C)(C)C |
Product Overview
N-tert-butyl-4-propoxybenzamide (CAS 876179-63-4), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: N-tert-butyl-4-propoxybenzamide.
Chemical Property Profile of N-tert-butyl-4-propoxybenzamide
Property Insights of N-tert-butyl-4-propoxybenzamide
The XLogP value of 3.0037 indicates that N-tert-butyl-4-propoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, N-tert-butyl-4-propoxybenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-4-propoxybenzamide has 1 hydrogen bond donor(s) and 2 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-tert-butyl-4-propoxybenzamide?
The CAS number of N-tert-butyl-4-propoxybenzamide is 876179-63-4.
What is the molecular formula of N-tert-butyl-4-propoxybenzamide?
The molecular formula of N-tert-butyl-4-propoxybenzamide is C14H21NO2.
What is the molecular weight of N-tert-butyl-4-propoxybenzamide?
The molecular weight of N-tert-butyl-4-propoxybenzamide is 235.16 g/mol.
Where can I buy N-tert-butyl-4-propoxybenzamide?
You can request a quote for N-tert-butyl-4-propoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-4-propoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-4-propoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.