Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride
TL;DR: Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride (CAS 27601-64-5) is a chemical compound with molecular formula C18H30ClN3O4 and molecular weight 387.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[2-(ethylcarbamoyloxy)ethyl]-(2-phenylethyl)azanium chloride
Also Known As: CARBAMIC ACID, ETHYL, DIESTER with PHENETHYLIMINODIETHANOL, HYDROCHLORIDE, Ethanol, 2,2'-phenethyliminodi-, bis(ethylcarbamate), hydrochloride, bis[2-(ethylcarbamoyloxy)ethyl]-phenethylazanium chloride, Carbamic acid, ethyl-, (phenethylimino)diethylene ester, monohydrochloride, RefChem:332428
| Molecular Formula | C18H30ClN3O4 |
|---|---|
| Molecular Weight | 387.19 g/mol |
| LogP | -2.39 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 387.19247 |
| Heavy Atoms | 26 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 27601-64-5 |
|---|---|
| SMILES | CCNC(=O)OCC[NH+](CCC1=CC=CC=C1)CCOC(=O)NCC.[Cl-] |
| InChIKey | XSCWWMRVJWXCMT-UHFFFAOYSA-N |
Product Overview
Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride (CAS 27601-64-5), with molecular formula C18H30ClN3O4 and molecular weight 387.19 g/mol. IUPAC: bis[2-(ethylcarbamoyloxy)ethyl]-(2-phenylethyl)azanium chloride.
Chemical Property Profile of Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride
Property Insights of Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride
The XLogP value of -2.39 indicates that Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride. Following Lipinski's Rule of Five, Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride has 3 hydrogen bond donor(s) and 5 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 Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride?
The CAS number of Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride is 27601-64-5.
What is the molecular formula of Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride?
The molecular formula of Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride is C18H30ClN3O4.
What is the molecular weight of Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride?
The molecular weight of Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride is 387.19 g/mol.
Where can I buy Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride?
You can request a quote for Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, ethyl, diester with phenethyliminodiethanol, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.