N-丁基-4-甲基苯甲酰胺
TL;DR: N-丁基-4-甲基苯甲酰胺 (CAS 6138-16-5) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-丁基-4-甲基苯甲酰胺
N-butyl-4-methylbenzamide
Also Known As: n-butyl-4-methylbenzamide, N-Butyl-p-toluamide, p-Toluamide, N-butyl-, Benzamide,N-butyl-4-methyl-, n-butyl p-methylbenzamide
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 6138-16-5 |
|---|---|
| SMILES | CCCCNC(=O)C1=CC=C(C=C1)C |
| InChIKey | VYVZZAYSPZXQDQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-丁基-4-甲基苯甲酰胺 (CAS 6138-16-5), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: N-butyl-4-methylbenzamide.
Chemical Property Profile of N-丁基-4-甲基苯甲酰胺
Property Insights of N-丁基-4-甲基苯甲酰胺
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-丁基-4-甲基苯甲酰胺. With a topological polar surface area (TPSA) of 29.1 Ų, N-丁基-4-甲基苯甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-丁基-4-甲基苯甲酰胺 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
Frequently Asked Questions
What is the CAS number of N-丁基-4-甲基苯甲酰胺?
The CAS number of N-丁基-4-甲基苯甲酰胺 is 6138-16-5.
What is the molecular formula of N-丁基-4-甲基苯甲酰胺?
The molecular formula of N-丁基-4-甲基苯甲酰胺 is C12H17NO.
What is the molecular weight of N-丁基-4-甲基苯甲酰胺?
The molecular weight of N-丁基-4-甲基苯甲酰胺 is 191.13 g/mol.
Where can I buy N-丁基-4-甲基苯甲酰胺?
You can request a quote for N-丁基-4-甲基苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-丁基-4-甲基苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-丁基-4-甲基苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.