Naphthoquine
TL;DR: Naphthoquine (CAS 173531-57-2) is a chemical compound with molecular formula C24H28ClN3O and molecular weight 409.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(tert-butylamino)methyl]-4-[(7-chloroquinolin-4-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
Also Known As: Naphthoquine, naphthoquine-phosphate, Naphthoquine (phosphate), NAPHTHOQUINE [WHO-DD], 4-(7-Chloro-4-aminoquinoline)-2-tert-butylaminomethyl-5,6,7,8-4hydro-1-naphthol
| Molecular Formula | C24H28ClN3O |
|---|---|
| Molecular Weight | 409.19 g/mol |
| LogP | 6.1043 |
| Topological Polar Surface Area | 57.18 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.19208 |
| Heavy Atoms | 29 |
| Complexity | 1056.1556 |
Chemical Identifiers
| CAS Number | 173531-57-2 |
|---|---|
| SMILES | CC(C)(C)NCC1=CC(=C2CCCCC2=C1O)NC3=C4C=CC(=CC4=NC=C3)Cl |
Product Overview
Naphthoquine (CAS 173531-57-2), with molecular formula C24H28ClN3O and molecular weight 409.19 g/mol. IUPAC: 2-[(tert-butylamino)methyl]-4-[(7-chloroquinolin-4-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol.
Chemical Property Profile of Naphthoquine
Property Insights of Naphthoquine
The XLogP value of 6.1043 indicates that Naphthoquine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.18 Ų, Naphthoquine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthoquine has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Naphthoquine?
The CAS number of Naphthoquine is 173531-57-2.
What is the molecular formula of Naphthoquine?
The molecular formula of Naphthoquine is C24H28ClN3O.
What is the molecular weight of Naphthoquine?
The molecular weight of Naphthoquine is 409.19 g/mol.
Where can I buy Naphthoquine?
You can request a quote for Naphthoquine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthoquine?
Yes, KEHONG BIO provides custom synthesis services for Naphthoquine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.