6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one
TL;DR: 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one (CAS 896071-08-2) is a chemical compound with molecular formula C21H21ClN2O3 and molecular weight 384.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-4-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]chromen-2-one
Also Known As: 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one, 6-chloro-4-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-2H-chromen-2-one, 6-chloro-4-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]chromen-2-one, 6-chloro-4-{[4-(4-methoxyphenyl)piperazinyl]methyl}chromen-2-one
| Molecular Formula | C21H21ClN2O3 |
|---|---|
| Molecular Weight | 384.12 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.12408 |
| Heavy Atoms | 27 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 896071-08-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)CC3=CC(=O)OC4=C3C=C(C=C4)Cl |
| InChIKey | XOAWGABLPXPHPD-UHFFFAOYSA-N |
Product Overview
6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one (CAS 896071-08-2), with molecular formula C21H21ClN2O3 and molecular weight 384.12 g/mol. IUPAC: 6-chloro-4-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]chromen-2-one.
Chemical Property Profile of 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one
Property Insights of 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one
The XLogP value of 3.5 indicates that 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one has 0 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 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one?
The CAS number of 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one is 896071-08-2.
What is the molecular formula of 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one?
The molecular formula of 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one is C21H21ClN2O3.
What is the molecular weight of 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one?
The molecular weight of 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one is 384.12 g/mol.
Where can I buy 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one?
You can request a quote for 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-4-((4-(4-methoxyphenyl)piperazin-1-yl)methyl)-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.