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N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide
TL;DR: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide (CAS 448223-76-5) is a chemical compound with molecular formula C13H17N3O and molecular weight 231.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-methylpropanamide
Also Known As: N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide, TimTec1_007472, BAS 07327389, IDI1_033126, N-[2-(1H-benzimidazol-2-yl)ethyl]-2-methylpropanamide
| Molecular Formula | C13H17N3O |
|---|---|
| Molecular Weight | 231.14 g/mol |
| LogP | 1.8776 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.13716 |
| Heavy Atoms | 17 |
| Complexity | 483.11386 |
Chemical Identifiers
| CAS Number | 448223-76-5 |
|---|---|
| SMILES | CC(C)C(=O)NCCC1=NC2=CC=CC=C2N1 |
Product Overview
N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide (CAS 448223-76-5), with molecular formula C13H17N3O and molecular weight 231.14 g/mol. IUPAC: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-methylpropanamide.
Chemical Property Profile of N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide
Property Insights of N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide
The XLogP value of 1.8776 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide. With a topological polar surface area (TPSA) of 57.78 Ų, N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide has 2 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-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide?
The CAS number of N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide is 448223-76-5.
What is the molecular formula of N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide?
The molecular formula of N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide is C13H17N3O.
What is the molecular weight of N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide?
The molecular weight of N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide is 231.14 g/mol.
Where can I buy N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide?
You can request a quote for N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(1H-1,3-benzodiazol-2-yl)ethyl]-2-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.