AH-9700 fumarate
TL;DR: AH-9700 fumarate (CAS 337359-08-7) is a chemical compound with molecular formula C22H29NO4 and molecular weight 371.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-[2-(6,7-dimethyl-3,4-dihydronaphthalen-2-yl)ethyl]pyrrolidine
Also Known As: AH-9700 fumarate, Pyrrolidine, 1-(2-(3,4-dihydro-6,7-dimethyl-2-naphthalenyl)ethyl)-, (2E)-2-butenedioate (1:1), (E)-but-2-enedioic acid;1-[2-(6,7-dimethyl-3,4-dihydronaphthalen-2-yl)ethyl]pyrrolidine, 1-(2-(3,4-dihydro-6,7-dimethyl-2-naphthalenyl)ethyl) pyrrolidine fumarate, IUPAC: But-2-enedioic Acid; 1-[2-(6,7-dimethyl-3,4-dihydronaphthalen-2-yl)ethyl]pyrrolidine
| Molecular Formula | C22H29NO4 |
|---|---|
| Molecular Weight | 371.21 g/mol |
| LogP | 3.83074 |
| Topological Polar Surface Area | 77.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.20966 |
| Heavy Atoms | 27 |
| Complexity | 726.9248 |
Chemical Identifiers
| CAS Number | 337359-08-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)C=C(CC2)CCN3CCCC3.C(=C/C(=O)O)\C(=O)O |
Product Overview
AH-9700 fumarate (CAS 337359-08-7), with molecular formula C22H29NO4 and molecular weight 371.21 g/mol. IUPAC: (E)-but-2-enedioic acid;1-[2-(6,7-dimethyl-3,4-dihydronaphthalen-2-yl)ethyl]pyrrolidine.
Chemical Property Profile of AH-9700 fumarate
Property Insights of AH-9700 fumarate
The XLogP value of 3.83074 indicates that AH-9700 fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-9700 fumarate. Following Lipinski's Rule of Five, AH-9700 fumarate has 2 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 AH-9700 fumarate?
The CAS number of AH-9700 fumarate is 337359-08-7.
What is the molecular formula of AH-9700 fumarate?
The molecular formula of AH-9700 fumarate is C22H29NO4.
What is the molecular weight of AH-9700 fumarate?
The molecular weight of AH-9700 fumarate is 371.21 g/mol.
Where can I buy AH-9700 fumarate?
You can request a quote for AH-9700 fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-9700 fumarate?
Yes, KEHONG BIO provides custom synthesis services for AH-9700 fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.