Quinelorane
TL;DR: Quinelorane (CAS 97466-90-5) is a chemical compound with molecular formula C14H22N4 and molecular weight 246.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5aR,9aR)-6-propyl-5a,7,8,9,9a,10-hexahydro-5H-pyrido[2,3-g]quinazolin-2-amine
Also Known As: Quinelorane, Quinelorano, Quineloranum, Quinerolane, Quinelorane [INN:BAN]
| Molecular Formula | C14H22N4 |
|---|---|
| Molecular Weight | 246.18 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.18445 |
| Heavy Atoms | 18 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 97466-90-5 |
|---|---|
| SMILES | CCCN1CCC[C@H]2[C@H]1CC3=CN=C(N=C3C2)N |
| InChIKey | TUFADSGTJUOBEH-ZWNOBZJWSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Quinelorane (CAS 97466-90-5), with molecular formula C14H22N4 and molecular weight 246.18 g/mol. IUPAC: (5aR,9aR)-6-propyl-5a,7,8,9,9a,10-hexahydro-5H-pyrido[2,3-g]quinazolin-2-amine.
Chemical Property Profile of Quinelorane
Property Insights of Quinelorane
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinelorane. With a topological polar surface area (TPSA) of 55.0 Ų, Quinelorane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinelorane has 1 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 Quinelorane?
The CAS number of Quinelorane is 97466-90-5.
What is the molecular formula of Quinelorane?
The molecular formula of Quinelorane is C14H22N4.
What is the molecular weight of Quinelorane?
The molecular weight of Quinelorane is 246.18 g/mol.
Where can I buy Quinelorane?
You can request a quote for Quinelorane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinelorane?
Yes, KEHONG BIO provides custom synthesis services for Quinelorane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.