Quinelorane Hydrochloride
TL;DR: Quinelorane Hydrochloride (CAS 97548-97-5) is a chemical compound with molecular formula C14H24Cl2N4 and molecular weight 318.14 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;dihydrochloride
Also Known As: Quinelorane hydrochloride, Quinelorane dihydrochloride, Quinelorane HCl, Quinelorane, Quinelorane (dihydrochloride)
| Molecular Formula | C14H24Cl2N4 |
|---|---|
| Molecular Weight | 318.14 g/mol |
| LogP | 2.49 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.13782 |
| Heavy Atoms | 20 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 97548-97-5 |
|---|---|
| SMILES | CCCN1CCC[C@H]2[C@H]1CC3=CN=C(N=C3C2)N.Cl.Cl |
| InChIKey | WDEMLQIGYYLRRX-OWVUFADGSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Quinelorane Hydrochloride (CAS 97548-97-5), with molecular formula C14H24Cl2N4 and molecular weight 318.14 g/mol. IUPAC: (5aR,9aR)-6-propyl-5a,7,8,9,9a,10-hexahydro-5H-pyrido[2,3-g]quinazolin-2-amine;dihydrochloride.
Chemical Property Profile of Quinelorane Hydrochloride
Property Insights of Quinelorane Hydrochloride
The XLogP value of 2.49 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinelorane Hydrochloride. With a topological polar surface area (TPSA) of 55.0 Ų, Quinelorane Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinelorane Hydrochloride has 3 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 Hydrochloride?
The CAS number of Quinelorane Hydrochloride is 97548-97-5.
What is the molecular formula of Quinelorane Hydrochloride?
The molecular formula of Quinelorane Hydrochloride is C14H24Cl2N4.
What is the molecular weight of Quinelorane Hydrochloride?
The molecular weight of Quinelorane Hydrochloride is 318.14 g/mol.
Where can I buy Quinelorane Hydrochloride?
You can request a quote for Quinelorane Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinelorane Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Quinelorane Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.