RefChem:319299
TL;DR: RefChem:319299 (CAS 4169-35-1) is a chemical compound with molecular formula C23H32ClN3O2 and molecular weight 417.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,6-dimethylanilino)-2-oxoethyl]-[1-(2,6-dimethylanilino)-1-oxopropan-2-yl]-dimethylazanium chloride
Also Known As: Dimethyl(1-(2,6-xylylcarbamoyl)ethyl)((2,6-xylylcarbamoyl)methyl)ammonium chloride, Ammonium, dimethyl(1-(2,6-xylylcarbamoyl)ethyl)((2,6-xylylcarbamoyl)methyl)-, chloride, [2-(2,6-dimethylanilino)-2-oxoethyl]-[1-(2,6-dimethylanilino)-1-oxopropan-2-yl]-dimethylazanium chloride, Ammonium,dimethyl(1-(2,6-xylylcarbamoyl)ethyl)((2,6-xylylcarbamoyl)methyl)-,chloride, [2-(2,6-dimethylanilino)-2-oxoethyl]-[1-(2,6-dimethylanilino)-1-oxopropan-2-yl]-dimethylazanium,chloride
| Molecular Formula | C23H32ClN3O2 |
|---|---|
| Molecular Weight | 417.22 g/mol |
| LogP | 0.97 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.2183 |
| Heavy Atoms | 29 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 4169-35-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)C[N+](C)(C)C(C)C(=O)NC2=C(C=CC=C2C)C.[Cl-] |
| InChIKey | QDTVNCVZQZIOEP-UHFFFAOYSA-N |
Product Overview
RefChem:319299 (CAS 4169-35-1), with molecular formula C23H32ClN3O2 and molecular weight 417.22 g/mol. IUPAC: [2-(2,6-dimethylanilino)-2-oxoethyl]-[1-(2,6-dimethylanilino)-1-oxopropan-2-yl]-dimethylazanium chloride.
Chemical Property Profile of RefChem:319299
Property Insights of RefChem:319299
The XLogP value of 0.97 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:319299. With a topological polar surface area (TPSA) of 58.2 Ų, RefChem:319299 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319299 has 2 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 RefChem:319299?
The CAS number of RefChem:319299 is 4169-35-1.
What is the molecular formula of RefChem:319299?
The molecular formula of RefChem:319299 is C23H32ClN3O2.
What is the molecular weight of RefChem:319299?
The molecular weight of RefChem:319299 is 417.22 g/mol.
Where can I buy RefChem:319299?
You can request a quote for RefChem:319299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319299?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.