N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide
TL;DR: N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide (CAS 503563-98-2) is a chemical compound with molecular formula C19H22ClNO and molecular weight 315.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide
Also Known As: N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide, N-benzyl-N-(tert-butyl)-2-chloro-4-methylbenzamide
| Molecular Formula | C19H22ClNO |
|---|---|
| Molecular Weight | 315.14 g/mol |
| LogP | 5.08932 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.13898 |
| Heavy Atoms | 22 |
| Complexity | 658.88055 |
Chemical Identifiers
| CAS Number | 503563-98-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC=C2)C(C)(C)C)Cl |
Product Overview
N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide (CAS 503563-98-2), with molecular formula C19H22ClNO and molecular weight 315.14 g/mol. IUPAC: N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide.
Chemical Property Profile of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide
Property Insights of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide
The XLogP value of 5.08932 indicates that N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide?
The CAS number of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide is 503563-98-2.
What is the molecular formula of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide?
The molecular formula of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide is C19H22ClNO.
What is the molecular weight of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide?
The molecular weight of N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide is 315.14 g/mol.
Where can I buy N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide?
You can request a quote for N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-N-tert-butyl-2-chloro-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.