2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide
TL;DR: 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide (CAS 102555-83-9) is a chemical compound with molecular formula C22H30ClN3O and molecular weight 387.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzyl-[2-(diethylamino)ethyl]amino]-N-(2-chloro-6-methylphenyl)acetamide
Also Known As: 2-(N-BENZYL-N-(2-DIETHYLAMINOETHYL)-AMINO)-6'-CHLORO-ORTHO-ACETOTOLUIDIDE, Acetamide, N-(2-chloro-6-methylphenyl)-2-[[2-(diethylamino)ethyl](phenylmethyl)amino]-, 2-[benzyl(2-diethylaminoethyl)amino]-N-(2-chloro-6-methylphenyl)acetamide, 2-(benzyl-(2-diethylaminoethyl)amino)-N-(2-chloro-6-methyl-phenyl)acetamide, 2-{benzyl[2-(diethylamino)ethyl]amino}-N-(2-chloro-6-methylphenyl)acetamide
| Molecular Formula | C22H30ClN3O |
|---|---|
| Molecular Weight | 387.21 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 387.20773 |
| Heavy Atoms | 27 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 102555-83-9 |
|---|---|
| SMILES | CCN(CC)CCN(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2Cl)C |
| InChIKey | IHBUSGGLXXXAML-UHFFFAOYSA-N |
Product Overview
2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide (CAS 102555-83-9), with molecular formula C22H30ClN3O and molecular weight 387.21 g/mol. IUPAC: 2-[benzyl-[2-(diethylamino)ethyl]amino]-N-(2-chloro-6-methylphenyl)acetamide.
Chemical Property Profile of 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide
Property Insights of 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide
The XLogP value of 4.4 indicates that 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.6 Ų, 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide has 1 hydrogen bond donor(s) and 3 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-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide?
The CAS number of 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide is 102555-83-9.
What is the molecular formula of 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide?
The molecular formula of 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide is C22H30ClN3O.
What is the molecular weight of 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide?
The molecular weight of 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide is 387.21 g/mol.
Where can I buy 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide?
You can request a quote for 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide?
Yes, KEHONG BIO provides custom synthesis services for 2-(N-Benzyl-N-(2-diethylaminoethyl)-amino)-6'-chloro-ortho-acetotoluidide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.