N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide
TL;DR: N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide (CAS 879575-49-2) is a chemical compound with molecular formula C22H21F2N3O3 and molecular weight 413.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-difluorophenyl)-4-[(2,4-dioxo-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide
Also Known As: N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide, N-(2,4-difluorophenyl)-4-[(2,4-dioxo-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide, N-(2,4-difluorophenyl)-4-[(2-hydroxy-4-oxoquinazolin-3(4H)-yl)methyl]cyclohexanecarboxamide
| Molecular Formula | C22H21F2N3O3 |
|---|---|
| Molecular Weight | 413.16 g/mol |
| LogP | 3.4131 |
| Topological Polar Surface Area | 83.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.1551 |
| Heavy Atoms | 30 |
| Complexity | 1210.2087 |
Chemical Identifiers
| CAS Number | 879575-49-2 |
|---|---|
| SMILES | C1CC(CCC1CN2C(=O)C3=CC=CC=C3NC2=O)C(=O)NC4=C(C=C(C=C4)F)F |
Product Overview
N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide (CAS 879575-49-2), with molecular formula C22H21F2N3O3 and molecular weight 413.16 g/mol. IUPAC: N-(2,4-difluorophenyl)-4-[(2,4-dioxo-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide.
Chemical Property Profile of N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide
Property Insights of N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide
The XLogP value of 3.4131 indicates that N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide. Following Lipinski's Rule of Five, N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide has 2 hydrogen bond donor(s) and 3 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 N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide?
The CAS number of N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide is 879575-49-2.
What is the molecular formula of N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide?
The molecular formula of N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide is C22H21F2N3O3.
What is the molecular weight of N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide?
The molecular weight of N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide is 413.16 g/mol.
Where can I buy N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide?
You can request a quote for N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-difluorophenyl)-4-((2,4-dioxo-1,2-dihydroquinazolin-3(4H)-yl)methyl)cyclohexanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.