RefChem:316265
TL;DR: RefChem:316265 (CAS 87576-04-3) is a chemical compound with molecular formula C16H25Cl2N3O2 and molecular weight 361.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[2-(azepan-1-ium-1-yl)ethyl]-2-(4-chlorophenoxy)acetohydrazide chloride
Also Known As: (4-Chlorophenoxy)acetic acid 2-(2-(hexahydro-1H-azepin-1-yl)ethyl)hydrazide hydrochloride, Acetic acid, (4-chlorophenoxy)-, 2-(2-(hexahydro-1H-azepin-1-yl)ethyl)hydrazide, monohydrochloride, N'-[2-(AZEPAN-1-IUM-1-YL)ETHYL]-2-(4-CHLOROPHENOXY)ACETOHYDRAZIDECHLORIDE, ACETIC ACID, (4-CHLOROPHENOXY)-, 2-(2-(HEXAHYDRO-1H-AZEPIN-1-YL)ETHYL)HYDRAZIDE,, N'-[2-(azepan-1-ium-1-yl)ethyl]-2-(4-chlorophenoxy)acetohydrazide chloride
| Molecular Formula | C16H25Cl2N3O2 |
|---|---|
| Molecular Weight | 361.13 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 361.1324 |
| Heavy Atoms | 23 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 87576-04-3 |
|---|---|
| SMILES | C1CCC[NH+](CC1)CCNNC(=O)COC2=CC=C(C=C2)Cl.[Cl-] |
| InChIKey | BBYJNYWBBULQAW-UHFFFAOYSA-N |
Product Overview
RefChem:316265 (CAS 87576-04-3), with molecular formula C16H25Cl2N3O2 and molecular weight 361.13 g/mol. IUPAC: N'-[2-(azepan-1-ium-1-yl)ethyl]-2-(4-chlorophenoxy)acetohydrazide chloride.
Chemical Property Profile of RefChem:316265
Property Insights of RefChem:316265
The XLogP value of -2.2 indicates that RefChem:316265 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.8 Ų, RefChem:316265 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:316265 has 3 hydrogen bond donor(s) and 4 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:316265?
The CAS number of RefChem:316265 is 87576-04-3.
What is the molecular formula of RefChem:316265?
The molecular formula of RefChem:316265 is C16H25Cl2N3O2.
What is the molecular weight of RefChem:316265?
The molecular weight of RefChem:316265 is 361.13 g/mol.
Where can I buy RefChem:316265?
You can request a quote for RefChem:316265 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:316265?
Yes, KEHONG BIO provides custom synthesis services for RefChem:316265 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.