starbld0000466
TL;DR: starbld0000466 (CAS 959576-50-2) is a chemical compound with molecular formula C18H22F3NO4 and molecular weight 373.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-2-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid
Also Known As: starbld0000466, Boc-(R)-alpha-(3-trifluoromethyl-benzyl)-proline, Boc-{Bzl(3-CF3)}Pro-OH, (R)-1-(tert-Butoxycarbonyl)-2-(3-(trifluoromethyl)benzyl)pyrrolidine-2-carboxylic acid, 6631AC
| Molecular Formula | C18H22F3NO4 |
|---|---|
| Molecular Weight | 373.15 g/mol |
| LogP | 4.1022 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.1501 |
| Heavy Atoms | 26 |
| Complexity | 696.412 |
Chemical Identifiers
| CAS Number | 959576-50-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC[C@@]1(CC2=CC(=CC=C2)C(F)(F)F)C(=O)O |
Product Overview
starbld0000466 (CAS 959576-50-2), with molecular formula C18H22F3NO4 and molecular weight 373.15 g/mol. IUPAC: (2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-2-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of starbld0000466
Property Insights of starbld0000466
The XLogP value of 4.1022 indicates that starbld0000466 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0000466. Following Lipinski's Rule of Five, starbld0000466 has 1 hydrogen bond donor(s) and 3 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 starbld0000466?
The CAS number of starbld0000466 is 959576-50-2.
What is the molecular formula of starbld0000466?
The molecular formula of starbld0000466 is C18H22F3NO4.
What is the molecular weight of starbld0000466?
The molecular weight of starbld0000466 is 373.15 g/mol.
Where can I buy starbld0000466?
You can request a quote for starbld0000466 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0000466?
Yes, KEHONG BIO provides custom synthesis services for starbld0000466 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.