2-butyl-N-phenylbenzamide
TL;DR: 2-butyl-N-phenylbenzamide (CAS 111787-49-6) is a chemical compound with molecular formula C17H19NO and molecular weight 253.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butyl-N-phenylbenzamide
Also Known As: 2-butyl-N-phenylbenzamide, 2-butyl-N-phenyl-benzamide
Technical Specifications
| Molecular Formula | C17H19NO |
| Molecular Weight | 253.14667 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.14667 Da |
| Heavy Atoms | 19 |
| Complexity | 270.0 |
| SMILES | CCCCC1=CC=CC=C1C(=O)NC2=CC=CC=C2 |
| InChIKey | CKZOICVHFAAWSF-UHFFFAOYSA-N |
Chemical Property Profile of 2-butyl-N-phenylbenzamide
Property Insights of 2-butyl-N-phenylbenzamide
The XLogP value of 4.4 indicates that 2-butyl-N-phenylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2-butyl-N-phenylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-butyl-N-phenylbenzamide 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 2-butyl-N-phenylbenzamide?
The CAS number of 2-butyl-N-phenylbenzamide is 111787-49-6.
What is the molecular formula of 2-butyl-N-phenylbenzamide?
The molecular formula of 2-butyl-N-phenylbenzamide is C17H19NO.
What is the molecular weight of 2-butyl-N-phenylbenzamide?
The molecular weight of 2-butyl-N-phenylbenzamide is 253.14667 g/mol.
Where can I buy 2-butyl-N-phenylbenzamide?
You can request a quote for 2-butyl-N-phenylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-butyl-N-phenylbenzamide?
Yes, CoreyChem provides custom synthesis services for 2-butyl-N-phenylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.