4-tert-butyl-N-(3-chlorophenyl)benzamide
TL;DR: 4-tert-butyl-N-(3-chlorophenyl)benzamide (CAS 129488-45-5) is a chemical compound with molecular formula C17H18ClNO and molecular weight 287.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-(3-chlorophenyl)benzamide
Also Known As: 4-tert-butyl-N-(3-chlorophenyl)benzamide, BAS 00664460, 4-(tert-butyl)-N-(3-chlorophenyl)benzamide, BIM-0017192.P001, N-(3-Chlorophenyl)-4-(1,1-dimethylethyl)benzamide
| Molecular Formula | C17H18ClNO |
|---|---|
| Molecular Weight | 287.11 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.1077 |
| Heavy Atoms | 20 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 129488-45-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)Cl |
| InChIKey | AUBMBUUVZCJOEJ-UHFFFAOYSA-N |
Product Overview
4-tert-butyl-N-(3-chlorophenyl)benzamide (CAS 129488-45-5), with molecular formula C17H18ClNO and molecular weight 287.11 g/mol. IUPAC: 4-tert-butyl-N-(3-chlorophenyl)benzamide.
Chemical Property Profile of 4-tert-butyl-N-(3-chlorophenyl)benzamide
Property Insights of 4-tert-butyl-N-(3-chlorophenyl)benzamide
The XLogP value of 5.5 indicates that 4-tert-butyl-N-(3-chlorophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 4-tert-butyl-N-(3-chlorophenyl)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-butyl-N-(3-chlorophenyl)benzamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-tert-butyl-N-(3-chlorophenyl)benzamide?
The CAS number of 4-tert-butyl-N-(3-chlorophenyl)benzamide is 129488-45-5.
What is the molecular formula of 4-tert-butyl-N-(3-chlorophenyl)benzamide?
The molecular formula of 4-tert-butyl-N-(3-chlorophenyl)benzamide is C17H18ClNO.
What is the molecular weight of 4-tert-butyl-N-(3-chlorophenyl)benzamide?
The molecular weight of 4-tert-butyl-N-(3-chlorophenyl)benzamide is 287.11 g/mol.
Where can I buy 4-tert-butyl-N-(3-chlorophenyl)benzamide?
You can request a quote for 4-tert-butyl-N-(3-chlorophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-butyl-N-(3-chlorophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N-(3-chlorophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.