![(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate structure](/static/products/103/103365-47-5.png)
(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
TL;DR: (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate (CAS 103365-47-5) is a chemical compound with molecular formula C14H18NO4- and molecular weight 264.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
Also Known As: Boc-?-Phe-OH, (S)-N-Boc-3-Amino-3-phenylpropanoic acid
| Molecular Formula | C14H18NO4- |
|---|---|
| Molecular Weight | 264.12 g/mol |
| LogP | 1.3924 |
| Topological Polar Surface Area | 78.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.1236 |
| Heavy Atoms | 19 |
| Complexity | 436.50922 |
Chemical Identifiers
| CAS Number | 103365-47-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC(=O)[O-])C1=CC=CC=C1 |
Product Overview
(3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate (CAS 103365-47-5), with molecular formula C14H18NO4- and molecular weight 264.12 g/mol. IUPAC: (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate.
Chemical Property Profile of (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
Property Insights of (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
The XLogP value of 1.3924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate. The TPSA of 78.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate. Following Lipinski's Rule of Five, (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate has 1 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 (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate?
The CAS number of (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate is 103365-47-5.
What is the molecular formula of (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate?
The molecular formula of (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate is C14H18NO4-.
What is the molecular weight of (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate?
The molecular weight of (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate is 264.12 g/mol.
Where can I buy (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate?
You can request a quote for (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.