RefChem:335293
TL;DR: RefChem:335293 (CAS 16795-57-6) is a chemical compound with molecular formula C21H31ClN2O and molecular weight 362.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(diethylamino)but-2-ynyl]-1-phenylcyclohexane-1-carboxamide;hydrochloride
Also Known As: Cyclohexanecarboxamide, N-(4-(diethylamino)-2-butynyl)-1-phenyl-, monohydrochloride, hydrate, N-(4-(Diethylamino)-2-butynyl)-1-phenylcyclohexanecarboxamide hydrochloride hydrate, N-[4-(diethylamino)but-2-ynyl]-1-phenylcyclohexane-1-carboxamide hydrochloride, N-[4-(Diethylamino)but-2-yn-1-yl]-1-phenylcyclohexane-1-carboxamide--hydrogen chloride (1/1), RefChem:335293
| Molecular Formula | C21H31ClN2O |
|---|---|
| Molecular Weight | 362.21 g/mol |
| LogP | 3.7717 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.2125 |
| Heavy Atoms | 25 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 16795-57-6 |
|---|---|
| SMILES | CCN(CC)CC#CCNC(=O)C1(CCCCC1)C2=CC=CC=C2.Cl |
| InChIKey | KKSYZNCMKMCOSX-UHFFFAOYSA-N |
Product Overview
RefChem:335293 (CAS 16795-57-6), with molecular formula C21H31ClN2O and molecular weight 362.21 g/mol. IUPAC: N-[4-(diethylamino)but-2-ynyl]-1-phenylcyclohexane-1-carboxamide;hydrochloride.
Chemical Property Profile of RefChem:335293
Property Insights of RefChem:335293
The XLogP value of 3.7717 indicates that RefChem:335293 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, RefChem:335293 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:335293 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:335293?
The CAS number of RefChem:335293 is 16795-57-6.
What is the molecular formula of RefChem:335293?
The molecular formula of RefChem:335293 is C21H31ClN2O.
What is the molecular weight of RefChem:335293?
The molecular weight of RefChem:335293 is 362.21 g/mol.
Where can I buy RefChem:335293?
You can request a quote for RefChem:335293 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:335293?
Yes, KEHONG BIO provides custom synthesis services for RefChem:335293 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.