(1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid
TL;DR: (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid (CAS 1173674-63-9) is a chemical compound with molecular formula C25H29NO6 and molecular weight 439.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid
Also Known As: (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid, 4-[[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid, trans-4-({[3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]amino}methyl)cyclohexanecarboxylic acid
| Molecular Formula | C25H29NO6 |
|---|---|
| Molecular Weight | 439.20 g/mol |
| LogP | 4.40426 |
| Topological Polar Surface Area | 109.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.1995 |
| Heavy Atoms | 32 |
| Complexity | 1243.0142 |
Chemical Identifiers
| CAS Number | 1173674-63-9 |
|---|---|
| SMILES | CC1=COC2=C(C3=C(C=C12)C(=C(C(=O)O3)CCC(=O)NCC4CCC(CC4)C(=O)O)C)C |
Product Overview
(1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid (CAS 1173674-63-9), with molecular formula C25H29NO6 and molecular weight 439.20 g/mol. IUPAC: 4-[[3-(3,5,9-trimethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]methyl]cyclohexane-1-carboxylic acid.
Chemical Property Profile of (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid
Property Insights of (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid
The XLogP value of 4.40426 indicates that (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid has 2 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 (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid?
The CAS number of (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid is 1173674-63-9.
What is the molecular formula of (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid?
The molecular formula of (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid is C25H29NO6.
What is the molecular weight of (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid?
The molecular weight of (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid is 439.20 g/mol.
Where can I buy (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid?
You can request a quote for (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for (1r,4r)-4-((3-(3,5,9-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)methyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.