RefChem:318607
TL;DR: RefChem:318607 (CAS 4061-36-3) is a chemical compound with molecular formula C19H23Cl2N3O2 and molecular weight 395.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-anilino-2-oxoethyl)-[2-(2-chloro-6-methylanilino)-2-oxoethyl]-dimethylazanium chloride
Also Known As: Ammonium, (((6-chloro-o-tolyl)carbamoyl)methyl)dimethyl((phenylcarbamoyl)methyl)-, chloride, (((6-Chloro-o-tolyl)carbamoyl)methyl)dimethyl((phenylcarbamoyl)methyl)ammonium chloride, (2-anilino-2-oxoethyl)-[2-(2-chloro-6-methylanilino)-2-oxoethyl]-dimethylazanium chloride, RefChem:318607
| Molecular Formula | C19H23Cl2N3O2 |
|---|---|
| Molecular Weight | 395.12 g/mol |
| LogP | 0.31 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.11673 |
| Heavy Atoms | 26 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 4061-36-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)C[N+](C)(C)CC(=O)NC2=CC=CC=C2.[Cl-] |
| InChIKey | PDEKURUQTKBWKN-UHFFFAOYSA-N |
Product Overview
RefChem:318607 (CAS 4061-36-3), with molecular formula C19H23Cl2N3O2 and molecular weight 395.12 g/mol. IUPAC: (2-anilino-2-oxoethyl)-[2-(2-chloro-6-methylanilino)-2-oxoethyl]-dimethylazanium chloride.
Chemical Property Profile of RefChem:318607
Property Insights of RefChem:318607
The XLogP value of 0.31 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:318607. With a topological polar surface area (TPSA) of 58.2 Ų, RefChem:318607 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318607 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:318607?
The CAS number of RefChem:318607 is 4061-36-3.
What is the molecular formula of RefChem:318607?
The molecular formula of RefChem:318607 is C19H23Cl2N3O2.
What is the molecular weight of RefChem:318607?
The molecular weight of RefChem:318607 is 395.12 g/mol.
Where can I buy RefChem:318607?
You can request a quote for RefChem:318607 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318607?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318607 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.