N-benzyl-4-chlorobutanamide
TL;DR: N-benzyl-4-chlorobutanamide (CAS 22813-61-2) is a chemical compound with molecular formula C11H14ClNO and molecular weight 211.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-4-chlorobutanamide
Also Known As: N-benzyl-4-chlorobutanamide, 4-Chlor-N-benzyl-butyramid, N-benzyl-4-chloro-butanamide, Butanamide, 4-chloro-N-(phenylmethyl)-
| Molecular Formula | C11H14ClNO |
|---|---|
| Molecular Weight | 211.08 g/mol |
| LogP | 2.3218 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 211.07639 |
| Heavy Atoms | 14 |
| Complexity | 273.87582 |
Chemical Identifiers
| CAS Number | 22813-61-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CCCCl |
Product Overview
N-benzyl-4-chlorobutanamide (CAS 22813-61-2), with molecular formula C11H14ClNO and molecular weight 211.08 g/mol. IUPAC: N-benzyl-4-chlorobutanamide.
Chemical Property Profile of N-benzyl-4-chlorobutanamide
Property Insights of N-benzyl-4-chlorobutanamide
The XLogP value of 2.3218 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-4-chlorobutanamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-benzyl-4-chlorobutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-4-chlorobutanamide 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-benzyl-4-chlorobutanamide?
The CAS number of N-benzyl-4-chlorobutanamide is 22813-61-2.
What is the molecular formula of N-benzyl-4-chlorobutanamide?
The molecular formula of N-benzyl-4-chlorobutanamide is C11H14ClNO.
What is the molecular weight of N-benzyl-4-chlorobutanamide?
The molecular weight of N-benzyl-4-chlorobutanamide is 211.08 g/mol.
Where can I buy N-benzyl-4-chlorobutanamide?
You can request a quote for N-benzyl-4-chlorobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-4-chlorobutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-4-chlorobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.