3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one
TL;DR: 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one (CAS 618390-38-8) is a chemical compound with molecular formula C30H40N4O6 and molecular weight 552.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]chromen-4-one
Also Known As: 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one, 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis((4-methylpiperazin-1-yl)methyl)-4H-chromen-4-one, 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis-(4-methylpiperazin-1-ylmethyl)chromen-4-one, 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]chromen-4-one, 3-(3,4-dimethoxyphenyl)-6,8-bis[(4-methylpiperazinyl)methyl]-5,7-dihydroxy-2-m ethylchromen-4-one
| Molecular Formula | C30H40N4O6 |
|---|---|
| Molecular Weight | 552.29 g/mol |
| LogP | 2.69162 |
| Topological Polar Surface Area | 102.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 552.2948 |
| Heavy Atoms | 40 |
| Complexity | 1438.8553 |
Chemical Identifiers
| CAS Number | 618390-38-8 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(C(=C(C(=C2O1)CN3CCN(CC3)C)O)CN4CCN(CC4)C)O)C5=CC(=C(C=C5)OC)OC |
Product Overview
3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one (CAS 618390-38-8), with molecular formula C30H40N4O6 and molecular weight 552.29 g/mol. IUPAC: 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]chromen-4-one.
Chemical Property Profile of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one
Property Insights of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one
The XLogP value of 2.69162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one. The TPSA of 102.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one. Following Lipinski's Rule of Five, 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one?
The CAS number of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one is 618390-38-8.
What is the molecular formula of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one?
The molecular formula of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one is C30H40N4O6.
What is the molecular weight of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one?
The molecular weight of 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one is 552.29 g/mol.
Where can I buy 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one?
You can request a quote for 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-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-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-6,8-bis[(4-methylpiperazin-1-yl)methyl]-4H-chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.