RefChem:1090879
TL;DR: RefChem:1090879 (CAS 77791-64-1) is a chemical compound with molecular formula C14H21Cl3N2O and molecular weight 338.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,6-dichloroanilino)-2-oxoethyl]-dipropylazanium chloride
Also Known As: 2',6'-Dichloro-2-(dipropylamino)acetanilide, hydrochloride, Acetamide, N-(2,6-dichlorophenyl)-2-(dipropylamino)-, monohydrochloride, ACETANILIDE, 2',6'-DICHLORO-2-(DIPROPYLAMINO)-, HYDROCHLORIDE, [2-(2,6-dichloroanilino)-2-oxoethyl]-dipropylazanium chloride, N-(2,6-Dichlorophenyl)-2-(dipropylamino)ethanimidic acid--hydrogen chloride (1/1)
| Molecular Formula | C14H21Cl3N2O |
|---|---|
| Molecular Weight | 338.07 g/mol |
| LogP | -0.36 |
| Topological Polar Surface Area | 33.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 338.07196 |
| Heavy Atoms | 20 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 77791-64-1 |
|---|---|
| SMILES | CCC[NH+](CCC)CC(=O)NC1=C(C=CC=C1Cl)Cl.[Cl-] |
| InChIKey | AQKHIEYSKLYOBC-UHFFFAOYSA-N |
Product Overview
RefChem:1090879 (CAS 77791-64-1), with molecular formula C14H21Cl3N2O and molecular weight 338.07 g/mol. IUPAC: [2-(2,6-dichloroanilino)-2-oxoethyl]-dipropylazanium chloride.
Chemical Property Profile of RefChem:1090879
Property Insights of RefChem:1090879
The XLogP value of -0.36 indicates that RefChem:1090879 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.5 Ų, RefChem:1090879 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1090879 has 2 hydrogen bond donor(s) and 2 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:1090879?
The CAS number of RefChem:1090879 is 77791-64-1.
What is the molecular formula of RefChem:1090879?
The molecular formula of RefChem:1090879 is C14H21Cl3N2O.
What is the molecular weight of RefChem:1090879?
The molecular weight of RefChem:1090879 is 338.07 g/mol.
Where can I buy RefChem:1090879?
You can request a quote for RefChem:1090879 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1090879?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1090879 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.