S693-1370 Screening compound: 3-cyclopentyl-1-{3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}propan-1-one

S693-1370 Screening compound: 3-cyclopentyl-1-{3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}propan-1-one
S693-1370 Screening compound: 3-cyclopentyl-1-{3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S693-1370
3-cyclopentyl-1-{3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}propan-1-one

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

S693-1370

Molecular Formula

C19H31N3O (C19 H31 N3 O)

Compound Name

3-cyclopentyl-1-{3-[(2,5-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}propan-1-one

IUPAC name

3-cyclopentyl-1-{3-[(25-dimethyl-1H-imidazol-1-yl)methyl]piperidin-1-yl}propan-1-one

SMILES

Cc1cnc(C)n1CC(CCC1)CN1C(CCC1CCCC1)=O

InChI

InChI=1S/C19H31N3O/c1-15-12-20-16(2)22(15)14-18-8-5-11-21(13-18)19(23)10-9-17-6-3-4-7-17/h12,17-18H,3-11,13-14H2,1-2H3/t18-/m0/s1

InChI Key

QLGICOPKTQIVEQ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD31977219

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.944

Distribution Coefficient, logD

1.604

Water Solubility, LogSw

-2.90

Polar Surface Area

28.813

Acid Dissociation Constant (pKa)

24.49

Base Dissociation Constant (pKb)

8.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

78.95

S693-1370 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 S693-1370 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S693-1370?
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What is the minimum amount of S693-1370 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S693-1370
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S693-1370
  • 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 S693-1370 available by request