RefChem:1054382
TL;DR: RefChem:1054382 (CAS 42020-71-3) is a chemical compound with molecular formula C24H31ClFNO2 and molecular weight 419.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-[[4-methoxy-4-(4-methylphenyl)cyclohexyl]amino]butan-1-one;hydrochloride
Also Known As: cis-4'-Fluoro-4-((4-methoxy-4-p-tolylcyclohexyl)amino)butyrophenone hydrochloride, Butyrophenone, 4'-fluoro-4-((4-methoxy-4-p-tolylcyclohexyl)amino)-, hydrochlroide, (Z)-, cis-N-(3-(p-Fluorobenzoyl)propyl)-4-methoxy-4-p-tolylcyclohexylamine hydrochloride, 1-(4-Fluorophenyl)-4-((4-methoxy-4-(4-methylphenyl)cyclohexyl)amino)butan-1-one--hydrogen chloride (1/1), 1-(4-fluorophenyl)-4-[[4-methoxy-4-(4-methylphenyl)cyclohexyl]amino]butan-1-one hydrochloride
| Molecular Formula | C24H31ClFNO2 |
|---|---|
| Molecular Weight | 419.20 g/mol |
| LogP | 5.59292 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 419.20273 |
| Heavy Atoms | 29 |
| Complexity | 768.4726 |
Chemical Identifiers
| CAS Number | 42020-71-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2(CCC(CC2)NCCCC(=O)C3=CC=C(C=C3)F)OC.Cl |
Product Overview
RefChem:1054382 (CAS 42020-71-3), with molecular formula C24H31ClFNO2 and molecular weight 419.20 g/mol. IUPAC: 1-(4-fluorophenyl)-4-[[4-methoxy-4-(4-methylphenyl)cyclohexyl]amino]butan-1-one;hydrochloride.
Chemical Property Profile of RefChem:1054382
Property Insights of RefChem:1054382
The XLogP value of 5.59292 indicates that RefChem:1054382 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, RefChem:1054382 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1054382 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1054382?
The CAS number of RefChem:1054382 is 42020-71-3.
What is the molecular formula of RefChem:1054382?
The molecular formula of RefChem:1054382 is C24H31ClFNO2.
What is the molecular weight of RefChem:1054382?
The molecular weight of RefChem:1054382 is 419.20 g/mol.
Where can I buy RefChem:1054382?
You can request a quote for RefChem:1054382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1054382?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1054382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.