PHA-543613 FUMARATE
TL;DR: PHA-543613 FUMARATE (CAS 708261-37-4) is a chemical compound with molecular formula C19H21N3O6 and molecular weight 387.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]furo[2,3-c]pyridine-5-carboxamide;(E)-but-2-enedioic acid
Also Known As: PHA-543613 FUMARATE, PHA-543613F, Furo[2,3-c]pyridine-5-carboxamide, N-(3R)-1-azabicyclo[2.2.2]oct-3-yl-, (2E)-2-butenedioate (1:1), N-(3R)-1-Azabicyclo[2.2.2]oct-3-ylfuro[2,3-c]pyridine-5-carboxamide (2E)-2-butenedioate (1:1)
| Molecular Formula | C19H21N3O6 |
|---|---|
| Molecular Weight | 387.14 g/mol |
| LogP | 1.3636 |
| Topological Polar Surface Area | 132.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.14304 |
| Heavy Atoms | 28 |
| Complexity | 881.96094 |
Chemical Identifiers
| CAS Number | 708261-37-4 |
|---|---|
| SMILES | C1CN2CCC1[C@H](C2)NC(=O)C3=NC=C4C(=C3)C=CO4.C(=C/C(=O)O)\C(=O)O |
Product Overview
PHA-543613 FUMARATE (CAS 708261-37-4), with molecular formula C19H21N3O6 and molecular weight 387.14 g/mol. IUPAC: N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]furo[2,3-c]pyridine-5-carboxamide;(E)-but-2-enedioic acid.
Chemical Property Profile of PHA-543613 FUMARATE
Property Insights of PHA-543613 FUMARATE
The XLogP value of 1.3636 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PHA-543613 FUMARATE. The TPSA of 132.97 Ų falls within the moderate polarity range, balancing permeability and solubility for PHA-543613 FUMARATE. Following Lipinski's Rule of Five, PHA-543613 FUMARATE has 3 hydrogen bond donor(s) and 6 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 PHA-543613 FUMARATE?
The CAS number of PHA-543613 FUMARATE is 708261-37-4.
What is the molecular formula of PHA-543613 FUMARATE?
The molecular formula of PHA-543613 FUMARATE is C19H21N3O6.
What is the molecular weight of PHA-543613 FUMARATE?
The molecular weight of PHA-543613 FUMARATE is 387.14 g/mol.
Where can I buy PHA-543613 FUMARATE?
You can request a quote for PHA-543613 FUMARATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for PHA-543613 FUMARATE?
Yes, KEHONG BIO provides custom synthesis services for PHA-543613 FUMARATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.