A2730/0115882
TL;DR: A2730/0115882 (CAS 371233-67-9) is a chemical compound with molecular formula C13H16F3N3O3 and molecular weight 319.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,3,3-trifluoro-2-(2-phenylhydrazinyl)-2-(propanoylamino)propanoate
Also Known As: A2730/0115882, methyl 3,3,3-trifluoro-2-(2-phenylhydrazinyl)-N-propanoylalaninate, (S)-methyl 3,3,3-trifluoro-2-(2-phenylhydrazinyl)-2-propionamidopropanoate, methyl 3,3,3-trifluoro-2-(2-phenylhydrazino)-2-(propanoylamino)propanoate, methyl 3,3,3-trifluoro-2-(2-phenylhydrazinyl)-2-(propanoylamino)propanoate
| Molecular Formula | C13H16F3N3O3 |
|---|---|
| Molecular Weight | 319.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 319.11438 |
| Heavy Atoms | 22 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 371233-67-9 |
|---|---|
| SMILES | CCC(=O)NC(C(=O)OC)(C(F)(F)F)NNC1=CC=CC=C1 |
| InChIKey | OICDDDILILKJCG-UHFFFAOYSA-N |
Product Overview
A2730/0115882 (CAS 371233-67-9), with molecular formula C13H16F3N3O3 and molecular weight 319.11 g/mol. IUPAC: methyl 3,3,3-trifluoro-2-(2-phenylhydrazinyl)-2-(propanoylamino)propanoate.
Chemical Property Profile of A2730/0115882
Property Insights of A2730/0115882
The XLogP value of 3.0 indicates that A2730/0115882 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for A2730/0115882. Following Lipinski's Rule of Five, A2730/0115882 has 3 hydrogen bond donor(s) and 8 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 A2730/0115882?
The CAS number of A2730/0115882 is 371233-67-9.
What is the molecular formula of A2730/0115882?
The molecular formula of A2730/0115882 is C13H16F3N3O3.
What is the molecular weight of A2730/0115882?
The molecular weight of A2730/0115882 is 319.11 g/mol.
Where can I buy A2730/0115882?
You can request a quote for A2730/0115882 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2730/0115882?
Yes, KEHONG BIO provides custom synthesis services for A2730/0115882 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.