Dpp-IV-IN-1
TL;DR: Dpp-IV-IN-1 (CAS 625110-37-4) is a chemical compound with molecular formula C11H18FN3O2 and molecular weight 243.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,4S)-4-fluoro-1-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]acetyl]pyrrolidine-2-carbonitrile
Also Known As: DPP-IV-IN-1, (2S,4S)-4-fluoro-1-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]acetyl]pyrrolidine-2-carbonitrile, (2S,4S)-4-Fluoro-1-((1-hydroxy-2-methylpropan-2-yl)glycyl)pyrrolidine-2-carbonitrile, (2S,4S)-4-Fluoro-1-[N-(2-hydroxy-1,1-dimethylethyl)glycyl]pyrrolidine-2-carbonitrile, (2S,4S)-4-Fluoro-1-{[(2-hydroxy-1,1-dimethylethyl)amino]acetyl}pyrrolidine-2-carbonitrile
| Molecular Formula | C11H18FN3O2 |
|---|---|
| Molecular Weight | 243.14 g/mol |
| LogP | -0.19052 |
| Topological Polar Surface Area | 76.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.1383 |
| Heavy Atoms | 17 |
| Complexity | 327.16846 |
Chemical Identifiers
| CAS Number | 625110-37-4 |
|---|---|
| SMILES | CC(C)(CO)NCC(=O)N1C[C@H](C[C@H]1C#N)F |
Product Overview
Dpp-IV-IN-1 (CAS 625110-37-4), with molecular formula C11H18FN3O2 and molecular weight 243.14 g/mol. IUPAC: (2S,4S)-4-fluoro-1-[2-[(1-hydroxy-2-methylpropan-2-yl)amino]acetyl]pyrrolidine-2-carbonitrile.
Chemical Property Profile of Dpp-IV-IN-1
Property Insights of Dpp-IV-IN-1
The XLogP value of -0.19052 indicates that Dpp-IV-IN-1 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Dpp-IV-IN-1. Following Lipinski's Rule of Five, Dpp-IV-IN-1 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
Frequently Asked Questions
What is the CAS number of Dpp-IV-IN-1?
The CAS number of Dpp-IV-IN-1 is 625110-37-4.
What is the molecular formula of Dpp-IV-IN-1?
The molecular formula of Dpp-IV-IN-1 is C11H18FN3O2.
What is the molecular weight of Dpp-IV-IN-1?
The molecular weight of Dpp-IV-IN-1 is 243.14 g/mol.
Where can I buy Dpp-IV-IN-1?
You can request a quote for Dpp-IV-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dpp-IV-IN-1?
Yes, KEHONG BIO provides custom synthesis services for Dpp-IV-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.