![trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid structure](/static/products/117/1173662-67-3.webp)
trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid
TL;DR: trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid (CAS 1173662-67-3) is a chemical compound with molecular formula C22H32N2O5 and molecular weight 404.2311 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]methyl]cyclohexane-1-carboxylic acid
Also Known As: trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid, (1S,4r)-4-(((S)-2-((tert-butoxycarbonyl)amino)-3-phenylpropanamido)methyl)cyclohexanecarboxylic acid, 4-[((S)-2-tert-Butoxycarbonylamino-3-phenyl-propionylamino)-methyl]-cyclohexanecarboxylic acid, 4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]methyl]cyclohexane-1-carboxylic acid
Technical Specifications
| Molecular Formula | C22H32N2O5 |
| Molecular Weight | 404.2311 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 404.2311 Da |
| Heavy Atoms | 29 |
| Complexity | 558.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC2CCC(CC2)C(=O)O |
| InChIKey | NECSGQGRHZUDDS-ABHNRTSZSA-N |
Chemical Property Profile of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid
Property Insights of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid
The XLogP value of 3.3 indicates that trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid. Following Lipinski's Rule of Five, trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid?
The CAS number of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid is 1173662-67-3.
What is the molecular formula of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid?
The molecular formula of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid is C22H32N2O5.
What is the molecular weight of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid?
The molecular weight of trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid is 404.2311 g/mol.
Where can I buy trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid?
You can request a quote for trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for trans-4-({[N-(tert-butoxycarbonyl)-L-phenylalanyl]amino}methyl)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.