S693-1765 Screening compound: 3-[(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)methyl]-1-[(3-fluorophenyl)methyl]piperidine

S693-1765 Screening compound: 3-[(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)methyl]-1-[(3-fluorophenyl)methyl]piperidine
S693-1765 Screening compound: 3-[(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)methyl]-1-[(3-fluorophenyl)methyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound S693-1765
3-[(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)methyl]-1-[(3-fluorophenyl)methyl]piperidine

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

S693-1765

Molecular Formula

C21H28FN3 (C21 H28 FN3)

Compound Name

3-[(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)methyl]-1-[(3-fluorophenyl)methyl]piperidine

IUPAC name

3-[(2-cyclobutyl-5-methyl-1H-imidazol-1-yl)methyl]-1-[(3-fluorophenyl)methyl]piperidine

SMILES

Cc1cnc(C2CCC2)n1CC1CN(Cc2cccc(F)c2)CCC1

InChI

InChI=1S/C21H28FN3/c1-16-12-23-21(19-7-3-8-19)25(16)15-18-6-4-10-24(14-18)13-17-5-2-9-20(22)11-17/h2,5,9,11-12,18-19H,3-4,6-8,10,13-15H2,1H3/t18-/m0/s1

InChI Key

MJCAHBATUDTJBL-SFHVURJKSA-N

MDL Number (MFCD)

MFCD31997338

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

341.47

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.695

Distribution Coefficient, logD

1.899

Water Solubility, LogSw

-3.67

Polar Surface Area

15.341

Acid Dissociation Constant (pKa)

24.84

Base Dissociation Constant (pKb)

9.19

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

57.14

S693-1765 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with S693-1765 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S693-1765?
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What is the minimum amount of S693-1765 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S693-1765
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S693-1765
  • 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 S693-1765 available by request