S830-3610 Screening compound: 3-({[1-(ethanesulfonyl)-4,4-difluoropiperidin-3-yl]methoxy}methyl)pyridine

S830-3610 Screening compound: 3-({[1-(ethanesulfonyl)-4,4-difluoropiperidin-3-yl]methoxy}methyl)pyridine
S830-3610 Screening compound: 3-({[1-(ethanesulfonyl)-4,4-difluoropiperidin-3-yl]methoxy}methyl)pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound S830-3610
3-({[1-(ethanesulfonyl)-4,4-difluoropiperidin-3-yl]methoxy}methyl)pyridine

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

S830-3610

Molecular Formula

C14H20F2N2O3S (C14 H20 F2 N2 O3 S)

Compound Name

3-({[1-(ethanesulfonyl)-4,4-difluoropiperidin-3-yl]methoxy}methyl)pyridine

IUPAC name

3-({[1-(ethanesulfonyl)-44-difluoropiperidin-3-yl]methoxy}methyl)pyridine

SMILES

CCS(N(CC1)CC(COCc2cnccc2)C1(F)F)(=O)=O

InChI

InChI=1S/C14H20F2N2O3S/c1-2-22(19,20)18-7-5-14(15,16)13(9-18)11-21-10-12-4-3-6-17-8-12/h3-4,6,8,13H,2,5,7,9-11H2,1H3/t13-/m1/s1

InChI Key

QRCVSNCQEGBOCX-CYBMUJFWSA-N

MDL Number (MFCD)

MFCD30468356

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.515

Distribution Coefficient, logD

1.515

Water Solubility, LogSw

-1.49

Polar Surface Area

49.729

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

3.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

64.29

S830-3610 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with S830-3610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S830-3610?
Check Price and Availability of S830-3610, 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 S830-3610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S830-3610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S830-3610
  • 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 S830-3610 available by request