T502-1464 Screening compound: 1-(ethanesulfonyl)-4-fluoro-4-(pyrrolidine-1-carbonyl)piperidine

T502-1464 Screening compound: 1-(ethanesulfonyl)-4-fluoro-4-(pyrrolidine-1-carbonyl)piperidine
T502-1464 Screening compound: 1-(ethanesulfonyl)-4-fluoro-4-(pyrrolidine-1-carbonyl)piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound T502-1464
1-(ethanesulfonyl)-4-fluoro-4-(pyrrolidine-1-carbonyl)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

T502-1464

Molecular Formula

C12H21FN2O3S (C12 H21 FN2 O3 S)

Compound Name

1-(ethanesulfonyl)-4-fluoro-4-(pyrrolidine-1-carbonyl)piperidine

IUPAC name

1-(ethanesulfonyl)-4-fluoro-4-(pyrrolidine-1-carbonyl)piperidine

SMILES

CCS(N(CC1)CCC1(C(N1CCCC1)=O)F)(=O)=O

InChI

InChI=1S/C12H21FN2O3S/c1-2-19(17,18)15-9-5-12(13,6-10-15)11(16)14-7-3-4-8-14/h2-10H2,1H3

InChI Key

KSSUZHLJHCUWCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31973229

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.37

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.972

Distribution Coefficient, logD

0.972

Water Solubility, LogSw

-1.50

Polar Surface Area

49.129

Acid Dissociation Constant (pKa)

22.12

Base Dissociation Constant (pKb)

-2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

91.67

T502-1464 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with T502-1464 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T502-1464?
Check Price and Availability of T502-1464, 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 T502-1464 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T502-1464
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T502-1464
  • 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 T502-1464 available by request