2,5-dichloro-N,N-diethylbenzamide
TL;DR: 2,5-dichloro-N,N-diethylbenzamide (CAS 79868-32-9) 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.
2,5-dichloro-N,N-diethylbenzamide
Also Known As: 2,5-dichloro-N,N-diethylbenzamide, 2,5-dichloro-N,N-diethyl-benzamide, (2,5-dichlorophenyl)-N,N-diethylcarboxamide
| Molecular Formula | C11H13Cl2NO |
|---|---|
| Molecular Weight | 245.04 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.03741 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 79868-32-9 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C=CC(=C1)Cl)Cl |
| InChIKey | QZQZZQVSKHUZSS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-dichloro-N,N-diethylbenzamide (CAS 79868-32-9), with molecular formula C11H13Cl2NO and molecular weight 245.04 g/mol. IUPAC: 2,5-dichloro-N,N-diethylbenzamide.
Chemical Property Profile of 2,5-dichloro-N,N-diethylbenzamide
Property Insights of 2,5-dichloro-N,N-diethylbenzamide
The XLogP value of 3.5 indicates that 2,5-dichloro-N,N-diethylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2,5-dichloro-N,N-diethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-dichloro-N,N-diethylbenzamide has 0 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 2,5-dichloro-N,N-diethylbenzamide?
The CAS number of 2,5-dichloro-N,N-diethylbenzamide is 79868-32-9.
What is the molecular formula of 2,5-dichloro-N,N-diethylbenzamide?
The molecular formula of 2,5-dichloro-N,N-diethylbenzamide is C11H13Cl2NO.
What is the molecular weight of 2,5-dichloro-N,N-diethylbenzamide?
The molecular weight of 2,5-dichloro-N,N-diethylbenzamide is 245.04 g/mol.
Where can I buy 2,5-dichloro-N,N-diethylbenzamide?
You can request a quote for 2,5-dichloro-N,N-diethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-dichloro-N,N-diethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2,5-dichloro-N,N-diethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.