![(3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid structure](/static/products/136/1366350-26-6.webp)
(3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid
TL;DR: (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid (CAS 1366350-26-6) is a chemical compound with molecular formula C18H27NO4 and molecular weight 321.194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(2-methylpropyl)phenyl]propanoic acid
Also Known As: (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid, (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(2-methylpropyl)phenyl]propanoic Acid
Technical Specifications
| Molecular Formula | C18H27NO4 |
| Molecular Weight | 321.194 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 321.194 Da |
| Heavy Atoms | 23 |
| Complexity | 392.0 |
| SMILES | CC(C)CC1=CC=C(C=C1)[C@H](CC(=O)O)NC(=O)OC(C)(C)C |
| InChIKey | ZRNVINSNQGCAMZ-HNNXBMFYSA-N |
Chemical Property Profile of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid
Property Insights of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid
The XLogP value of 3.5 indicates that (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid. Following Lipinski's Rule of Five, (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid 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
What is the CAS number of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid?
The CAS number of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid is 1366350-26-6.
What is the molecular formula of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid?
The molecular formula of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid is C18H27NO4.
What is the molecular weight of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid?
The molecular weight of (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid is 321.194 g/mol.
Where can I buy (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid?
You can request a quote for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid?
Yes, CoreyChem provides custom synthesis services for (3S)-3-{[(tert-butoxy)carbonyl]amino}-3-[4-(2-methylpropyl)phenyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.