Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride
TL;DR: Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride (CAS 52507-55-8) is a chemical compound with molecular formula C21H29N3O6S and molecular weight 451.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-anilino-4-oxo-3-(phenylcarbamoyl)butyl]-diethylazanium;hydrogen sulfate
Also Known As: Dethamid, Dethamide, Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride, 2-(2-(Diethylamino)ethyl)-N,N'-diphenylpropanediamide monohydrochloride, [4-Anilino-4-oxo-3-(phenylcarbamoyl)butyl]-diethylazanium; hydrogensulfate
| Molecular Formula | C21H29N3O6S |
|---|---|
| Molecular Weight | 451.18 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 451.1777 |
| Heavy Atoms | 31 |
| Complexity | 469.0 |
Chemical Identifiers
| CAS Number | 52507-55-8 |
|---|---|
| SMILES | CC[NH+](CC)CCC(C(=O)NC1=CC=CC=C1)C(=O)NC2=CC=CC=C2.OS(=O)(=O)[O-] |
| InChIKey | IPJCCZXGFJRLGU-UHFFFAOYSA-N |
Product Overview
Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride (CAS 52507-55-8), with molecular formula C21H29N3O6S and molecular weight 451.18 g/mol. IUPAC: [4-anilino-4-oxo-3-(phenylcarbamoyl)butyl]-diethylazanium;hydrogen sulfate.
Chemical Property Profile of Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride
Property Insights of Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride. The TPSA of 148.0 Ų indicates high polarity, suggesting Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride has 4 hydrogen bond donor(s) and 6 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 Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride?
The CAS number of Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride is 52507-55-8.
What is the molecular formula of Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride?
The molecular formula of Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride is C21H29N3O6S.
What is the molecular weight of Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride?
The molecular weight of Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride is 451.18 g/mol.
Where can I buy Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride?
You can request a quote for Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Propanediamide, 2-(2-(diethylamino)ethyl)-N,N'-diphenyl-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.