N-tert-butyl-2,4-dichlorobenzamide
TL;DR: N-tert-butyl-2,4-dichlorobenzamide (CAS 61176-08-7) is a chemical compound with molecular formula C11H13Cl2NO and molecular weight 245.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2,4-dichlorobenzamide
Also Known As: N-tert-butyl-2,4-dichlorobenzamide, n-t-butyl-2,4-dichlorobenzamide, N-TERT-BUTYL-2,4-DICHLORO-BENZAMIDE, J3.684.209A, (2,4-dichlorophenyl)-N-(tert-butyl)carboxamide
| Molecular Formula | C11H13Cl2NO |
|---|---|
| Molecular Weight | 245.04 g/mol |
| LogP | 3.5217 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 245.03741 |
| Heavy Atoms | 15 |
| Complexity | 382.66458 |
Chemical Identifiers
| CAS Number | 61176-08-7 |
|---|---|
| SMILES | CC(C)(C)NC(=O)C1=C(C=C(C=C1)Cl)Cl |
Product Overview
N-tert-butyl-2,4-dichlorobenzamide (CAS 61176-08-7), with molecular formula C11H13Cl2NO and molecular weight 245.04 g/mol. IUPAC: N-tert-butyl-2,4-dichlorobenzamide.
Chemical Property Profile of N-tert-butyl-2,4-dichlorobenzamide
Property Insights of N-tert-butyl-2,4-dichlorobenzamide
The XLogP value of 3.5217 indicates that N-tert-butyl-2,4-dichlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, N-tert-butyl-2,4-dichlorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-2,4-dichlorobenzamide 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-tert-butyl-2,4-dichlorobenzamide?
The CAS number of N-tert-butyl-2,4-dichlorobenzamide is 61176-08-7.
What is the molecular formula of N-tert-butyl-2,4-dichlorobenzamide?
The molecular formula of N-tert-butyl-2,4-dichlorobenzamide is C11H13Cl2NO.
What is the molecular weight of N-tert-butyl-2,4-dichlorobenzamide?
The molecular weight of N-tert-butyl-2,4-dichlorobenzamide is 245.04 g/mol.
Where can I buy N-tert-butyl-2,4-dichlorobenzamide?
You can request a quote for N-tert-butyl-2,4-dichlorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-2,4-dichlorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-2,4-dichlorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.