RefChem:1083114
TL;DR: RefChem:1083114 (CAS 102504-36-9) is a chemical compound with molecular formula C14H21ClN3O- and molecular weight 282.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-(2-phenyl-2,3-dihydro-1,3,4-oxadiazol-5-yl)ethanamine chloride
Also Known As: delta(sup 4)-1,2,4-Oxadiazoline, 5-(2-(diethylamino)ethyl)-3-phenyl-, hydrochloride, 5-(2-(Diethylamino)ethyl)-3-phenyl-delta(sup 4)-1,2,4-oxadiazoline hydrochloride, 1,3,4-oxadiazole-2-ethanamine, n,n-diethyl-4,5-dihydro-5-phenyl-, chloride(1:1), N,N-diethyl-2-(2-phenyl-2,3-dihydro-1,3,4-oxadiazol-5-yl)ethanamine chloride, RefChem:1083114
| Molecular Formula | C14H21ClN3O- |
|---|---|
| Molecular Weight | 282.14 g/mol |
| LogP | -0.65 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 282.13733 |
| Heavy Atoms | 19 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 102504-36-9 |
|---|---|
| SMILES | CCN(CC)CCC1=NNC(O1)C2=CC=CC=C2.[Cl-] |
| InChIKey | HSOFQAUFOOOLJS-UHFFFAOYSA-M |
Product Overview
RefChem:1083114 (CAS 102504-36-9), with molecular formula C14H21ClN3O- and molecular weight 282.14 g/mol. IUPAC: N,N-diethyl-2-(2-phenyl-2,3-dihydro-1,3,4-oxadiazol-5-yl)ethanamine chloride.
Chemical Property Profile of RefChem:1083114
Property Insights of RefChem:1083114
The XLogP value of -0.65 indicates that RefChem:1083114 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.9 Ų, RefChem:1083114 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1083114 has 1 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 RefChem:1083114?
The CAS number of RefChem:1083114 is 102504-36-9.
What is the molecular formula of RefChem:1083114?
The molecular formula of RefChem:1083114 is C14H21ClN3O-.
What is the molecular weight of RefChem:1083114?
The molecular weight of RefChem:1083114 is 282.14 g/mol.
Where can I buy RefChem:1083114?
You can request a quote for RefChem:1083114 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1083114?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1083114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.