6623-1525 Screening compound: N-butyl-4-fluoro-N-{8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl}benzamide

6623-1525 Screening compound: N-butyl-4-fluoro-N-{8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl}benzamide
6623-1525 Screening compound: N-butyl-4-fluoro-N-{8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6623-1525
N-butyl-4-fluoro-N-{8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl}benzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6623-1525

Molecular Formula

C19H25FN2O (C19 H25 FN2 O)

Compound Name

N-butyl-4-fluoro-N-{8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl}benzamide

IUPAC name

N-butyl-4-fluoro-N-{8-methyl-8-azabicyclo[3.2.1]oct-2-en-3-yl}benzamide

SMILES

CCCCN(C(c(cc1)ccc1F)=O)C1=CC(CC2)N(C)C2C1

InChI

InChI=1S/C19H25FN2O/c1-3-4-11-22(19(23)14-5-7-15(20)8-6-14)18-12-16-9-10-17(13-18)21(16)2/h5-8,12,16-17H,3-4,9-11,13H2,1-2H3

InChI Key

FPNVTFWFUHBNPU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01605546

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

316.42

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.429

Distribution Coefficient, logD

1.834

Water Solubility, LogSw

-3.44

Polar Surface Area

19.074

Acid Dissociation Constant (pKa)

27.22

Base Dissociation Constant (pKb)

8.98

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

52.60

6623-1525 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 6623-1525 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6623-1525?
Check Price and Availability of 6623-1525, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6623-1525 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6623-1525
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6623-1525
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6623-1525 available by request