3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one
TL;DR: 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one (CAS 902308-98-9) is a chemical compound with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]-7-hydroxy-4,8-dimethylchromen-2-one
Also Known As: 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one, 3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxo-propyl]-7-hydroxy-4,8-dimethyl-chromen-2-one, 3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]-7-hydroxy-4,8-dimethylchromen-2-one, 3-{3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl}-7-hydroxy-4,8-dimethyl-2H-chromen-2-one
| Molecular Formula | C26H30N2O4 |
|---|---|
| Molecular Weight | 434.22 g/mol |
| LogP | 4.01368 |
| Topological Polar Surface Area | 73.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 434.22055 |
| Heavy Atoms | 32 |
| Complexity | 1236.786 |
Chemical Identifiers
| CAS Number | 902308-98-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCC3=C(C4=C(C(=C(C=C4)O)C)OC3=O)C)C |
Product Overview
3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one (CAS 902308-98-9), with molecular formula C26H30N2O4 and molecular weight 434.22 g/mol. IUPAC: 3-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]-7-hydroxy-4,8-dimethylchromen-2-one.
Chemical Property Profile of 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one
Property Insights of 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one
The XLogP value of 4.01368 indicates that 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one. Following Lipinski's Rule of Five, 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one 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 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one?
The CAS number of 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one is 902308-98-9.
What is the molecular formula of 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one?
The molecular formula of 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one is C26H30N2O4.
What is the molecular weight of 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one?
The molecular weight of 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one is 434.22 g/mol.
Where can I buy 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one?
You can request a quote for 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-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 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)-3-oxopropyl)-7-hydroxy-4,8-dimethyl-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.