4-Tert-butyl-N-heptylbenzamide
TL;DR: 4-Tert-butyl-N-heptylbenzamide (CAS 141993-73-9) is a chemical compound with molecular formula C18H29NO and molecular weight 275.2249 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-tert-butyl-N-heptylbenzamide
Also Known As: 4-tert-butyl-N-heptylbenzamide, N-heptyl-4-tert-butyl-benzamide, [4-(tert-butyl)phenyl]-N-heptylcarboxamide, 657-496-2
Technical Specifications
| Molecular Formula | C18H29NO |
| Molecular Weight | 275.2249 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 275.2249 Da |
| Heavy Atoms | 20 |
| Complexity | 272.0 |
| SMILES | CCCCCCCNC(=O)C1=CC=C(C=C1)C(C)(C)C |
| InChIKey | AVJIMKKDBFLRTH-UHFFFAOYSA-N |
Chemical Property Profile of 4-Tert-butyl-N-heptylbenzamide
Property Insights of 4-Tert-butyl-N-heptylbenzamide
The XLogP value of 4.6 indicates that 4-Tert-butyl-N-heptylbenzamide 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-heptylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-N-heptylbenzamide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Tert-butyl-N-heptylbenzamide?
The CAS number of 4-Tert-butyl-N-heptylbenzamide is 141993-73-9.
What is the molecular formula of 4-Tert-butyl-N-heptylbenzamide?
The molecular formula of 4-Tert-butyl-N-heptylbenzamide is C18H29NO.
What is the molecular weight of 4-Tert-butyl-N-heptylbenzamide?
The molecular weight of 4-Tert-butyl-N-heptylbenzamide is 275.2249 g/mol.
Where can I buy 4-Tert-butyl-N-heptylbenzamide?
You can request a quote for 4-Tert-butyl-N-heptylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Tert-butyl-N-heptylbenzamide?
Yes, CoreyChem provides custom synthesis services for 4-Tert-butyl-N-heptylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.