7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
TL;DR: 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one (CAS 903584-06-5) is a chemical compound with molecular formula C22H20F3NO3 and molecular weight 403.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-6-methyl-8-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
Also Known As: 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one, 7-hydroxy-6-methyl-8-({[3-(trifluoromethyl)benzyl]amino}methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one, 7-hydroxy-6-methyl-8-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one
| Molecular Formula | C22H20F3NO3 |
|---|---|
| Molecular Weight | 403.14 g/mol |
| LogP | 4.60432 |
| Topological Polar Surface Area | 62.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.13953 |
| Heavy Atoms | 29 |
| Complexity | 1148.7184 |
Chemical Identifiers
| CAS Number | 903584-06-5 |
|---|---|
| SMILES | CC1=C(C(=CC2=C1OC(=O)C3=C2CCC3)CNCC4=CC(=CC=C4)C(F)(F)F)O |
Product Overview
7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one (CAS 903584-06-5), with molecular formula C22H20F3NO3 and molecular weight 403.14 g/mol. IUPAC: 7-hydroxy-6-methyl-8-[[[3-(trifluoromethyl)phenyl]methylamino]methyl]-2,3-dihydro-1H-cyclopenta[c]chromen-4-one.
Chemical Property Profile of 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
Property Insights of 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one
The XLogP value of 4.60432 indicates that 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one. Following Lipinski's Rule of Five, 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one has 2 hydrogen bond donor(s) and 4 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 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
The CAS number of 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one is 903584-06-5.
What is the molecular formula of 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
The molecular formula of 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one is C22H20F3NO3.
What is the molecular weight of 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
The molecular weight of 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one is 403.14 g/mol.
Where can I buy 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
You can request a quote for 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 7-hydroxy-6-methyl-8-(((3-(trifluoromethyl)benzyl)amino)methyl)-2,3-dihydrocyclopenta[c]chromen-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.