Boc-D-threo-3-phenylserine
TL;DR: Boc-D-threo-3-phenylserine (CAS 180690-87-3) is a chemical compound with molecular formula C14H19NO5 and molecular weight 281.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid
Also Known As: BOC-D-THREO-3-PHENYLSERINE, Boc-D-threo-3-Ph-Ser-OMe, J1.218.761K, (2R, 3S)/(2S, 3R)-Racemic boc-beta-hydroxyphenylalanine, I14-24515
| Molecular Formula | C14H19NO5 |
|---|---|
| Molecular Weight | 281.13 g/mol |
| LogP | 1.6979 |
| Topological Polar Surface Area | 95.86 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.1263 |
| Heavy Atoms | 20 |
| Complexity | 466.20264 |
Chemical Identifiers
| CAS Number | 180690-87-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@H]([C@H](C1=CC=CC=C1)O)C(=O)O |
Product Overview
Boc-D-threo-3-phenylserine (CAS 180690-87-3), with molecular formula C14H19NO5 and molecular weight 281.13 g/mol. IUPAC: (2R,3S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid.
Chemical Property Profile of Boc-D-threo-3-phenylserine
Property Insights of Boc-D-threo-3-phenylserine
The XLogP value of 1.6979 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-D-threo-3-phenylserine. The TPSA of 95.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-D-threo-3-phenylserine. Following Lipinski's Rule of Five, Boc-D-threo-3-phenylserine has 3 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 Boc-D-threo-3-phenylserine?
The CAS number of Boc-D-threo-3-phenylserine is 180690-87-3.
What is the molecular formula of Boc-D-threo-3-phenylserine?
The molecular formula of Boc-D-threo-3-phenylserine is C14H19NO5.
What is the molecular weight of Boc-D-threo-3-phenylserine?
The molecular weight of Boc-D-threo-3-phenylserine is 281.13 g/mol.
Where can I buy Boc-D-threo-3-phenylserine?
You can request a quote for Boc-D-threo-3-phenylserine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-D-threo-3-phenylserine?
Yes, KEHONG BIO provides custom synthesis services for Boc-D-threo-3-phenylserine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.