Nictindole
TL;DR: Nictindole (CAS 36504-64-0) is a chemical compound with molecular formula C17H16N2O and molecular weight 264.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-propan-2-yl-1H-indol-3-yl)-pyridin-3-ylmethanone
Also Known As: Nictindole, Nictindol, Nictindolum, Nictindole [INN], Nictindol [INN-Spanish]
| Molecular Formula | C17H16N2O |
|---|---|
| Molecular Weight | 264.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 264.12625 |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 36504-64-0 |
|---|---|
| SMILES | CC(C)C1=C(C2=CC=CC=C2N1)C(=O)C3=CN=CC=C3 |
| InChIKey | SOOXXPIIPHUERK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nictindole (CAS 36504-64-0), with molecular formula C17H16N2O and molecular weight 264.13 g/mol. IUPAC: (2-propan-2-yl-1H-indol-3-yl)-pyridin-3-ylmethanone.
Chemical Property Profile of Nictindole
Property Insights of Nictindole
The XLogP value of 3.5 indicates that Nictindole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Nictindole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nictindole has 1 hydrogen bond donor(s) and 2 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 Nictindole?
The CAS number of Nictindole is 36504-64-0.
What is the molecular formula of Nictindole?
The molecular formula of Nictindole is C17H16N2O.
What is the molecular weight of Nictindole?
The molecular weight of Nictindole is 264.13 g/mol.
Where can I buy Nictindole?
You can request a quote for Nictindole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nictindole?
Yes, KEHONG BIO provides custom synthesis services for Nictindole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.